smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC(C)(C)c1nnc(C[NH2+][C@@]2(CO)CCc3cc(Br)ccc3C2)o1 ZINC000859571736 1126112838 /nfs/dbraw/zinc/11/28/38/1126112838.db2.gz HYXXSTBWARAVTJ-SFHVURJKSA-N 1 1 394.313 3.139 10 0 GGAEMO COc1cc(-c2noc(C[NH2+][C@@](C)(CO)Cc3ccc(F)cc3)n2)ccc1C ZINC001176599625 1126150387 /nfs/dbraw/zinc/15/03/87/1126150387.db2.gz PHDCOYRQMSQTNY-OAQYLSRUSA-N 1 1 385.439 3.276 10 0 GGAEMO C[C@](CO)(Cc1ccccc1F)[NH2+]Cc1nc(-c2ccc(F)c(F)c2)no1 ZINC001198219246 1126154852 /nfs/dbraw/zinc/15/48/52/1126154852.db2.gz NDJAXWIOXCRKRR-LJQANCHMSA-N 1 1 377.366 3.237 10 0 GGAEMO COc1ccc(C[C@@](C)(CO)[NH2+]Cc2c(F)c(F)c(F)c(F)c2F)cc1 ZINC001473839159 1126199637 /nfs/dbraw/zinc/19/96/37/1126199637.db2.gz UEVOQQXXEZTVFL-SFHVURJKSA-N 1 1 375.337 3.474 10 0 GGAEMO C[C@@](CO)(Cc1ccc(F)cc1)[NH2+]Cc1nc(-c2cc(F)c(F)c(F)c2)no1 ZINC001620625467 1126242516 /nfs/dbraw/zinc/24/25/16/1126242516.db2.gz URIVYDJAJXIQJX-IBGZPJMESA-N 1 1 395.356 3.376 10 0 GGAEMO C[C@@](CO)(Cc1ccc(F)cc1)[NH2+]Cc1nc(-c2ccc(F)c(F)c2)no1 ZINC001648466605 1126250478 /nfs/dbraw/zinc/25/04/78/1126250478.db2.gz LLMOCEIATYIKBC-IBGZPJMESA-N 1 1 377.366 3.237 10 0 GGAEMO COc1ccccc1C[C@](C)(CO)[NH2+]Cc1c(F)c(F)c(F)c(F)c1F ZINC001654634996 1126254265 /nfs/dbraw/zinc/25/42/65/1126254265.db2.gz ZAZJTDZUEDQTSC-GOSISDBHSA-N 1 1 375.337 3.474 10 0 GGAEMO COc1ccccc1C[C@@](C)(CO)[NH2+]Cc1c(F)c(F)c(F)c(F)c1F ZINC001654634999 1126254342 /nfs/dbraw/zinc/25/43/42/1126254342.db2.gz ZAZJTDZUEDQTSC-SFHVURJKSA-N 1 1 375.337 3.474 10 0 GGAEMO CC(C)c1nsc(C[NH2+][C@@]2(CO)CCc3cc(Br)ccc3C2)n1 ZINC001659421694 1126263443 /nfs/dbraw/zinc/26/34/43/1126263443.db2.gz SASPSAYJWDHRAL-KRWDZBQOSA-N 1 1 396.354 3.434 10 0 GGAEMO COc1cccc(-c2nnc(C[NH2+][C@@](C)(CO)Cc3ccc(Cl)cc3)o2)c1 ZINC001660393649 1126264955 /nfs/dbraw/zinc/26/49/55/1126264955.db2.gz VTZDSLPDBRWSIS-HXUWFJFHSA-N 1 1 387.867 3.482 10 0 GGAEMO O=C([C@@H]1CCCC[C@H]1C(=O)N1CCC[N@H+]2CCC[C@H]2C1)N1CCc2ccccc21 ZINC000241401118 231039338 /nfs/dbraw/zinc/03/93/38/231039338.db2.gz NBHQIJSEWLMMLP-PWRODBHTSA-N 1 1 395.547 3.079 10 0 GGAEMO CN(C[C@H]1COc2ccccc2O1)C(=O)C[N@@H+](C)[C@H]1CCCc2ccccc21 ZINC000241588404 529972778 /nfs/dbraw/zinc/97/27/78/529972778.db2.gz PCXQMOCMSIGFOQ-ICSRJNTNSA-N 1 1 380.488 3.294 10 0 GGAEMO C[C@H]1C[N@H+](Cc2cccc(CNc3ncncc3Br)c2)CCO1 ZINC000481680300 532668942 /nfs/dbraw/zinc/66/89/42/532668942.db2.gz YJJIDQVEQXCMGN-ZDUSSCGKSA-N 1 1 377.286 3.072 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2cccc(CNc3ncncc3Br)c2)CCO1 ZINC000481680300 532668949 /nfs/dbraw/zinc/66/89/49/532668949.db2.gz YJJIDQVEQXCMGN-ZDUSSCGKSA-N 1 1 377.286 3.072 10 0 GGAEMO CC(=O)c1ccc(OC[C@@H](O)C[NH+]2CCN(c3ccc(C)c(C)c3)CC2)cc1 ZINC000031371679 203835636 /nfs/dbraw/zinc/83/56/36/203835636.db2.gz QXTVYOXRHUFOMG-QFIPXVFZSA-N 1 1 382.504 3.068 10 0 GGAEMO CC[C@@H]1CCCC[N@H+]1CCCNC(=O)C[C@H]1Sc2ccccc2NC1=O ZINC000004712641 204068414 /nfs/dbraw/zinc/06/84/14/204068414.db2.gz ZGDHEOYRFAQULK-CRAIPNDOSA-N 1 1 375.538 3.260 10 0 GGAEMO CC[C@H]1CCCC[N@H+]1CCCNC(=O)CCS(=O)(=O)Cc1ccc(C)cc1 ZINC000004711130 204068677 /nfs/dbraw/zinc/06/86/77/204068677.db2.gz IQHOSLHQFUBLKP-FQEVSTJZSA-N 1 1 394.581 3.071 10 0 GGAEMO COc1ccc(NC(=O)NCCC[NH+]2CCN(c3ccccc3F)CC2)cc1 ZINC000004791775 204075746 /nfs/dbraw/zinc/07/57/46/204075746.db2.gz ZIBVDORKVYBRDK-UHFFFAOYSA-N 1 1 386.471 3.168 10 0 GGAEMO CC[C@H]1CCCC[N@H+]1CCCNC(=O)Cn1cccc1C(=O)c1ccccc1 ZINC000005142433 204114226 /nfs/dbraw/zinc/11/42/26/204114226.db2.gz OVHIZGQFYHSZSQ-FQEVSTJZSA-N 1 1 381.520 3.490 10 0 GGAEMO C[N@@H+](CCCNC(=O)Cn1cccc1C(=O)c1ccccc1)C1CCCCC1 ZINC000005142538 204114986 /nfs/dbraw/zinc/11/49/86/204114986.db2.gz DBRSUWCRVQXEFU-UHFFFAOYSA-N 1 1 381.520 3.490 10 0 GGAEMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)Cn2cccc2C(=O)c2ccccc2)C1 ZINC000005142489 204115875 /nfs/dbraw/zinc/11/58/75/204115875.db2.gz KRWXHALHJFQRKO-KDURUIRLSA-N 1 1 381.520 3.203 10 0 GGAEMO C[NH+]1CCN(c2ccc(-c3cccc(NC(=O)c4ccccc4F)c3)nn2)CC1 ZINC000004939847 204094783 /nfs/dbraw/zinc/09/47/83/204094783.db2.gz SSJJUWLKLXOPJP-UHFFFAOYSA-N 1 1 391.450 3.287 10 0 GGAEMO CC[C@H](C)[N@@H+](C)C1CCN(C(=O)CNC(=O)/C=C/c2cccc(Cl)c2)CC1 ZINC000005057778 204108584 /nfs/dbraw/zinc/10/85/84/204108584.db2.gz DSGUCSYLRNVZNU-FDMDGMSGSA-N 1 1 391.943 3.191 10 0 GGAEMO C=C1C(NCC[NH+]2CCCCCC2)=NS(=O)(=O)C1c1cccc(Cl)c1 ZINC000006797305 204207567 /nfs/dbraw/zinc/20/75/67/204207567.db2.gz WIVOQSJPCBESSZ-UHFFFAOYSA-N 1 1 381.929 3.279 10 0 GGAEMO CC[C@H]1CCCC[N@H+]1CCCNC(=O)Cn1ncc2c1-c1ccccc1OC2 ZINC000006805267 204209264 /nfs/dbraw/zinc/20/92/64/204209264.db2.gz BCKPHTOHIBKVPJ-SFHVURJKSA-N 1 1 382.508 3.213 10 0 GGAEMO CC[C@@H]1CCCC[N@H+]1CCCNC(=O)Cn1ncc2c1-c1ccccc1OC2 ZINC000006805266 204209854 /nfs/dbraw/zinc/20/98/54/204209854.db2.gz BCKPHTOHIBKVPJ-GOSISDBHSA-N 1 1 382.508 3.213 10 0 GGAEMO O=C(NCC[NH+]1CCCC1)c1ccc(C[S@@](=O)Cc2ccccc2Cl)o1 ZINC000006895865 204221829 /nfs/dbraw/zinc/22/18/29/204221829.db2.gz UOKBBWBNULMPGK-AREMUKBSSA-N 1 1 394.924 3.208 10 0 GGAEMO CC1=C(C(=O)NCCC[N@@H+]2C[C@H](C)C[C@H](C)C2)C2(CCCCCC2)OC1=O ZINC000006933647 204224799 /nfs/dbraw/zinc/22/47/99/204224799.db2.gz ICVBRYLXJLYRFN-CALCHBBNSA-N 1 1 376.541 3.437 10 0 biogenic GGAEMO CC1CC[NH+](CN2C(=O)N[C@](Cc3ccccc3)(c3ccccc3)C2=O)CC1 ZINC000007074484 204232631 /nfs/dbraw/zinc/23/26/31/204232631.db2.gz YNMWKDYEWVQWPP-HSZRJFAPSA-N 1 1 377.488 3.366 10 0 GGAEMO COc1ccc(C[N@H+](CC(=O)N2CCN(c3ccccc3F)CC2)C2CC2)cc1 ZINC000007244382 204237488 /nfs/dbraw/zinc/23/74/88/204237488.db2.gz HPNFYXDLQRRJRP-UHFFFAOYSA-N 1 1 397.494 3.148 10 0 GGAEMO COc1ccc(C[N@@H+](CC(=O)N2CCN(c3ccccc3F)CC2)C2CC2)cc1 ZINC000007244382 204237493 /nfs/dbraw/zinc/23/74/93/204237493.db2.gz HPNFYXDLQRRJRP-UHFFFAOYSA-N 1 1 397.494 3.148 10 0 GGAEMO O=C(C[N@@H+]1CCC[C@@H]1c1ccc2c(c1)OCCCO2)NCc1ccccc1F ZINC000007684832 204246542 /nfs/dbraw/zinc/24/65/42/204246542.db2.gz OXACGNUOOMQUGN-LJQANCHMSA-N 1 1 384.451 3.440 10 0 GGAEMO O=C(C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCCO2)NCc1ccccc1F ZINC000007684832 204246544 /nfs/dbraw/zinc/24/65/44/204246544.db2.gz OXACGNUOOMQUGN-LJQANCHMSA-N 1 1 384.451 3.440 10 0 GGAEMO COc1ccc(-c2nn(-c3ccccc3)cc2C[N@@H+]2CCCC[C@@H]2C(N)=O)cc1 ZINC000007973421 204256789 /nfs/dbraw/zinc/25/67/89/204256789.db2.gz JRRYXNCBACVQAD-OAQYLSRUSA-N 1 1 390.487 3.388 10 0 GGAEMO COc1ccc(-c2nn(-c3ccccc3)cc2C[N@H+]2CCCC[C@@H]2C(N)=O)cc1 ZINC000007973421 204256792 /nfs/dbraw/zinc/25/67/92/204256792.db2.gz JRRYXNCBACVQAD-OAQYLSRUSA-N 1 1 390.487 3.388 10 0 GGAEMO COc1ccc(-c2nn(-c3ccccc3)cc2C[N@@H+]2CCCC[C@H]2C(N)=O)cc1 ZINC000007973425 204256841 /nfs/dbraw/zinc/25/68/41/204256841.db2.gz JRRYXNCBACVQAD-NRFANRHFSA-N 1 1 390.487 3.388 10 0 GGAEMO COc1ccc(-c2nn(-c3ccccc3)cc2C[N@H+]2CCCC[C@H]2C(N)=O)cc1 ZINC000007973425 204256845 /nfs/dbraw/zinc/25/68/45/204256845.db2.gz JRRYXNCBACVQAD-NRFANRHFSA-N 1 1 390.487 3.388 10 0 GGAEMO Cn1cccc1[C@H]1CCC[N@H+]1CC(=O)N1CCN(c2ccccc2Cl)CC1 ZINC000008780378 204289857 /nfs/dbraw/zinc/28/98/57/204289857.db2.gz SESLSZMJOLGXIQ-HXUWFJFHSA-N 1 1 386.927 3.164 10 0 GGAEMO CSc1ccc(C[N@H+](C)CC(=O)Nc2ccccc2C(=O)NC2CC2)cc1 ZINC000008066188 204260586 /nfs/dbraw/zinc/26/05/86/204260586.db2.gz FSSJUIKVKKSTSY-UHFFFAOYSA-N 1 1 383.517 3.371 10 0 GGAEMO CSc1ccc(C[N@@H+](C)CC(=O)Nc2ccccc2C(=O)NC2CC2)cc1 ZINC000008066188 204260591 /nfs/dbraw/zinc/26/05/91/204260591.db2.gz FSSJUIKVKKSTSY-UHFFFAOYSA-N 1 1 383.517 3.371 10 0 GGAEMO O=C(C[NH+]1CCC(Cc2ccccc2)CC1)c1c[nH]c(C(=O)N2CCCC2)c1 ZINC000008075092 204261851 /nfs/dbraw/zinc/26/18/51/204261851.db2.gz DDCWEOKLIOZVSG-UHFFFAOYSA-N 1 1 379.504 3.388 10 0 GGAEMO C[C@@H](C(=O)NC(=O)NC1CCCCC1)[N@@H+](C)CCOc1ccc(Cl)cc1 ZINC000008120600 204262175 /nfs/dbraw/zinc/26/21/75/204262175.db2.gz GLTNDLFWYIRHSI-AWEZNQCLSA-N 1 1 381.904 3.198 10 0 GGAEMO COc1cc(C)c(C[N@H+](C)[C@@H](C)C(=O)Nc2ccc(NC(C)=O)cc2)cc1OC ZINC000008130911 204263268 /nfs/dbraw/zinc/26/32/68/204263268.db2.gz BZCUNNFNSQQVAS-HNNXBMFYSA-N 1 1 399.491 3.430 10 0 GGAEMO COc1cc(C)c(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc(NC(C)=O)cc2)cc1OC ZINC000008130911 204263273 /nfs/dbraw/zinc/26/32/73/204263273.db2.gz BZCUNNFNSQQVAS-HNNXBMFYSA-N 1 1 399.491 3.430 10 0 GGAEMO C[N@H+](CC(=O)N[C@H]1CCCc2ccccc21)Cc1ccccc1N1CCOCC1 ZINC000008160529 204264766 /nfs/dbraw/zinc/26/47/66/204264766.db2.gz OFWJWZDPCCZDJB-QFIPXVFZSA-N 1 1 393.531 3.149 10 0 GGAEMO C[N@@H+](CC(=O)N[C@H]1CCCc2ccccc21)Cc1ccccc1N1CCOCC1 ZINC000008160529 204264771 /nfs/dbraw/zinc/26/47/71/204264771.db2.gz OFWJWZDPCCZDJB-QFIPXVFZSA-N 1 1 393.531 3.149 10 0 GGAEMO O=c1cc(C[N@@H+]2CCC[C@H]2c2ccc3c(c2)OCCCO3)nc2sccn21 ZINC000008271373 204267983 /nfs/dbraw/zinc/26/79/83/204267983.db2.gz RLLROVAXNJUZRA-INIZCTEOSA-N 1 1 383.473 3.254 10 0 GGAEMO O=c1cc(C[N@H+]2CCC[C@H]2c2ccc3c(c2)OCCCO3)nc2sccn21 ZINC000008271373 204267988 /nfs/dbraw/zinc/26/79/88/204267988.db2.gz RLLROVAXNJUZRA-INIZCTEOSA-N 1 1 383.473 3.254 10 0 GGAEMO O=C(C[N@@H+]1CCC[C@@H]1c1ccc2c(c1)OCCCO2)NCCc1ccccc1 ZINC000008310378 204271279 /nfs/dbraw/zinc/27/12/79/204271279.db2.gz RYPCOYJDSIDNOG-HXUWFJFHSA-N 1 1 380.488 3.344 10 0 GGAEMO O=C(C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCCO2)NCCc1ccccc1 ZINC000008310378 204271283 /nfs/dbraw/zinc/27/12/83/204271283.db2.gz RYPCOYJDSIDNOG-HXUWFJFHSA-N 1 1 380.488 3.344 10 0 GGAEMO C[C@H](C(=O)NC(=O)NC1CC1)[N@H+](C)Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000011432578 204346373 /nfs/dbraw/zinc/34/63/73/204346373.db2.gz HRGUIYWUZICJBF-GFCCVEGCSA-N 1 1 375.856 3.409 10 0 GGAEMO C[C@H](C(=O)NC(=O)NC1CC1)[N@@H+](C)Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000011432578 204346378 /nfs/dbraw/zinc/34/63/78/204346378.db2.gz HRGUIYWUZICJBF-GFCCVEGCSA-N 1 1 375.856 3.409 10 0 GGAEMO O=C(C[NH+]1CCC(NC(=O)c2ccccc2)CC1)Nc1cccc2ncccc21 ZINC000011506828 204346528 /nfs/dbraw/zinc/34/65/28/204346528.db2.gz NZMHJJHXCTUWAA-UHFFFAOYSA-N 1 1 388.471 3.068 10 0 GGAEMO CNC(=O)[C@@H]1C[C@H](Sc2nc3ccccc3[nH]2)C[N@H+]1Cc1cccc(C)c1 ZINC000011785147 204352583 /nfs/dbraw/zinc/35/25/83/204352583.db2.gz ZXFFIWWHQOHAEC-LPHOPBHVSA-N 1 1 380.517 3.353 10 0 GGAEMO O=C1N(Cc2ccc(F)c(F)c2)CCC[C@]12CC[N@@H+](CCCn1cccn1)C2 ZINC000012029182 204367821 /nfs/dbraw/zinc/36/78/21/204367821.db2.gz VPGUIHHZRAOVNF-OAQYLSRUSA-N 1 1 388.462 3.066 10 0 GGAEMO COc1ccc(CC[N@@H+](C)[C@H]2CCCN(C(=O)NC(C)(C)C)C2)cc1OC ZINC000012050819 204368510 /nfs/dbraw/zinc/36/85/10/204368510.db2.gz RGLZNFGEIDPESY-KRWDZBQOSA-N 1 1 377.529 3.151 10 0 GGAEMO CN1CCCN(C(=O)[C@H]2CC23CC[NH+](CC2=CC[C@H]4C[C@@H]2C4(C)C)CC3)CC1 ZINC000012154920 204376620 /nfs/dbraw/zinc/37/66/20/204376620.db2.gz YLQFJIKUFTUGAG-PCCBWWKXSA-N 1 1 385.596 3.245 10 0 GGAEMO Cc1ccc(CN(C)C(=O)C[N@H+]2CCC[C@@H](C(=O)Nc3ccccc3)C2)cc1 ZINC000012326998 204399284 /nfs/dbraw/zinc/39/92/84/204399284.db2.gz MWBMSVDVVAMTMO-HXUWFJFHSA-N 1 1 379.504 3.304 10 0 GGAEMO Cc1ccc(CN(C)C(=O)C[N@H+]2CCC[C@H](C(=O)Nc3ccccc3)C2)cc1 ZINC000012326992 204399433 /nfs/dbraw/zinc/39/94/33/204399433.db2.gz MWBMSVDVVAMTMO-FQEVSTJZSA-N 1 1 379.504 3.304 10 0 GGAEMO O=C(c1cc(-c2cn[nH]c2)nc2ccc(F)cc21)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000020209469 204706834 /nfs/dbraw/zinc/70/68/34/204706834.db2.gz CAZXQPAKEYGHHZ-MRXNPFEDSA-N 1 1 379.439 3.074 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)COCc1cc(-c2cccs2)on1 ZINC000021528111 204758052 /nfs/dbraw/zinc/75/80/52/204758052.db2.gz PUHPOTMAPMEFBH-OAHLLOKOSA-N 1 1 377.510 3.300 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CNC(=O)c1cnn(-c2cccc(C)c2)c1-n1cccc1 ZINC000020979982 204747463 /nfs/dbraw/zinc/74/74/63/204747463.db2.gz MBKACXMGEORAKE-IBGZPJMESA-N 1 1 377.492 3.186 10 0 GGAEMO O=C(COc1ccc(-c2ccccc2)cc1)N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000023717554 204810857 /nfs/dbraw/zinc/81/08/57/204810857.db2.gz HENZLLDYTAZDBO-QFIPXVFZSA-N 1 1 380.488 3.056 10 0 GGAEMO Cc1ccc(NC(=O)N2CC[NH+](CCn3cnc4cccnc43)CC2)c(Cl)c1 ZINC000033139687 204947985 /nfs/dbraw/zinc/94/79/85/204947985.db2.gz MQIBUGUNPOQUNH-UHFFFAOYSA-N 1 1 398.898 3.243 10 0 GGAEMO C[N@H+]1CCC[C@H](CN2CCN(C(=O)Nc3ccc(Cl)c(Cl)c3)CC2)C1 ZINC000035967642 205000469 /nfs/dbraw/zinc/00/04/69/205000469.db2.gz ZXBGDMYNCLFGDV-AWEZNQCLSA-N 1 1 385.339 3.485 10 0 GGAEMO CCNC(=O)NC[C@@H]1c2cc(OC)c(OC)cc2CC[N@H+]1Cc1ccc(C)cc1 ZINC000036041078 205003102 /nfs/dbraw/zinc/00/31/02/205003102.db2.gz YZVBRWGTDJHKMI-HXUWFJFHSA-N 1 1 397.519 3.431 10 0 GGAEMO CCNC(=O)NC[C@@H]1c2cc(OC)c(OC)cc2CC[N@@H+]1Cc1ccc(C)cc1 ZINC000036041078 205003105 /nfs/dbraw/zinc/00/31/05/205003105.db2.gz YZVBRWGTDJHKMI-HXUWFJFHSA-N 1 1 397.519 3.431 10 0 GGAEMO COc1ccc(C[N@@H+](C[C@H](O)COCc2ccccc2)C[C@@H]2CCCO2)cc1 ZINC000036095262 205005198 /nfs/dbraw/zinc/00/51/98/205005198.db2.gz DNBYZIGABNUDHN-GMAHTHKFSA-N 1 1 385.504 3.254 10 0 GGAEMO Cc1ccc(C[N@@H+](Cc2ccc3c(c2)OCO3)C[C@@H](O)COC(C)(C)C)o1 ZINC000036097827 205005242 /nfs/dbraw/zinc/00/52/42/205005242.db2.gz GVWQEHOKQMUZIP-QGZVFWFLSA-N 1 1 375.465 3.495 10 0 GGAEMO Cc1ccc(C[N@H+](Cc2ccc3c(c2)OCO3)C[C@@H](O)COC(C)(C)C)o1 ZINC000036097827 205005245 /nfs/dbraw/zinc/00/52/45/205005245.db2.gz GVWQEHOKQMUZIP-QGZVFWFLSA-N 1 1 375.465 3.495 10 0 GGAEMO CC[C@@H](C)[N@H+](Cc1cc(OC)cc(OC)c1)C[C@H](O)COCc1ccco1 ZINC000036095088 205005461 /nfs/dbraw/zinc/00/54/61/205005461.db2.gz FCSRENDJJCMILH-AEFFLSMTSA-N 1 1 377.481 3.475 10 0 GGAEMO CC(C)OC[C@H](O)C[N@@H+](Cc1ccc(F)cc1)Cc1ccc2c(c1)OCO2 ZINC000036102565 205005554 /nfs/dbraw/zinc/00/55/54/205005554.db2.gz ZGNIUCXMGYMDAK-LJQANCHMSA-N 1 1 375.440 3.343 10 0 GGAEMO COc1cccc(C[N@@H+](C[C@H](O)COCc2ccccc2)C[C@H]2CCCO2)c1 ZINC000036100267 205005629 /nfs/dbraw/zinc/00/56/29/205005629.db2.gz CCSFFZXXRJDHTL-JTHBVZDNSA-N 1 1 385.504 3.254 10 0 GGAEMO CC[C@H](C)[N@H+](Cc1cc(OC)cc(OC)c1)C[C@H](O)COCc1ccco1 ZINC000036095089 205005696 /nfs/dbraw/zinc/00/56/96/205005696.db2.gz FCSRENDJJCMILH-WMZOPIPTSA-N 1 1 377.481 3.475 10 0 GGAEMO COc1ccc(C[N@@H+](C[C@H](O)Cc2ccccc2)C[C@H]2CCCO2)cc1OC ZINC000036096068 205005954 /nfs/dbraw/zinc/00/59/54/205005954.db2.gz WKOIPQHLGKCXDR-NHCUHLMSSA-N 1 1 385.504 3.288 10 0 GGAEMO COCCC[N@H+](Cc1ccc(F)cc1F)C[C@@H](O)COCc1ccccc1 ZINC000036099707 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COc1ccc(CNC(=O)c2[nH]c3cc(C)sc3c2C[NH+]2CCOCC2)cc1 ZINC000065139014 205212791 /nfs/dbraw/zinc/21/27/91/205212791.db2.gz HMXTUFVHHXGCCT-UHFFFAOYSA-N 1 1 399.516 3.309 10 0 GGAEMO CCn1cc(CC[NH+]2CCN(C(=O)Cc3ccc(C)cc3)CC2)c2cccnc21 ZINC000065164629 205214139 /nfs/dbraw/zinc/21/41/39/205214139.db2.gz ARRNCZNZFGJCGI-UHFFFAOYSA-N 1 1 390.531 3.294 10 0 GGAEMO Cn1cc(CC[NH+]2CCN(C(=O)c3ccc(Cl)cc3)CC2)c2cccnc21 ZINC000065164576 205214434 /nfs/dbraw/zinc/21/44/34/205214434.db2.gz UNRPMFMJWHUJBN-UHFFFAOYSA-N 1 1 382.895 3.227 10 0 GGAEMO CC[NH+]1CCN(C(=O)c2ccc(NC(=O)C3CC3)cc2N2CCCCCC2)CC1 ZINC000065165957 205214520 /nfs/dbraw/zinc/21/45/20/205214520.db2.gz YRZOLJHYRKHKRA-UHFFFAOYSA-N 1 1 398.551 3.193 10 0 GGAEMO CCn1cc(CC[NH+]2CCN(C(=O)c3ccccc3C)CC2)c2cccnc21 ZINC000065164698 205214568 /nfs/dbraw/zinc/21/45/68/205214568.db2.gz CBCWWLDJCNZRPS-UHFFFAOYSA-N 1 1 376.504 3.365 10 0 GGAEMO CCn1cc(CC[NH+]2CCN(C(=O)c3ccc(C)cc3)CC2)c2cccnc21 ZINC000065164702 205214805 /nfs/dbraw/zinc/21/48/05/205214805.db2.gz RLYCFAITFNGMEZ-UHFFFAOYSA-N 1 1 376.504 3.365 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1csc(-c2ccc(N3CCCC3)nc2)n1 ZINC000065165319 205215070 /nfs/dbraw/zinc/21/50/70/205215070.db2.gz GZMJOUKDHWIJQK-MRXNPFEDSA-N 1 1 399.564 3.410 10 0 GGAEMO O=C(C[NH+]1CCC(c2nc(-c3cccs3)no2)CC1)NCc1ccccc1 ZINC000065184244 205215880 /nfs/dbraw/zinc/21/58/80/205215880.db2.gz XSMFSHCHPFUCRH-UHFFFAOYSA-N 1 1 382.489 3.294 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CNC(=O)c1nc(-c2ccc(N3CCCCCC3)cc2)no1 ZINC000064746554 205193729 /nfs/dbraw/zinc/19/37/29/205193729.db2.gz RANQJOVPMJHYBE-IBGZPJMESA-N 1 1 397.523 3.331 10 0 GGAEMO CCc1csc(-c2ccc(S(=O)(=O)NCC[NH+]3CCC(C)CC3)s2)n1 ZINC000064755856 205193856 /nfs/dbraw/zinc/19/38/56/205193856.db2.gz HKSOCLUIFRXGLQ-UHFFFAOYSA-N 1 1 399.607 3.444 10 0 GGAEMO COc1cc(CNC(=O)C2=CC[N@@H+](Cc3ccc(F)cc3)CC2)cc(OC)c1 ZINC000064818071 205196161 /nfs/dbraw/zinc/19/61/61/205196161.db2.gz IMOBUTCYVBCLQH-UHFFFAOYSA-N 1 1 384.451 3.291 10 0 GGAEMO Fc1cccc(-c2nc(-c3ccc4c(c3)ncn4CC[NH+]3CCOCC3)no2)c1 ZINC000065255091 205223660 /nfs/dbraw/zinc/22/36/60/205223660.db2.gz DMMLWLYBLIGGAQ-UHFFFAOYSA-N 1 1 393.422 3.225 10 0 GGAEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccn2c(c1)nnc2-c1ccc(F)cc1 ZINC000065296318 205228281 /nfs/dbraw/zinc/22/82/81/205228281.db2.gz REKYJIDOGAAKAT-HNNXBMFYSA-N 1 1 381.455 3.140 10 0 GGAEMO CC(C)[NH+]1CCN(C(=O)c2cccc3c2CCN3C(=O)Nc2ccccc2)CC1 ZINC000065210122 205219502 /nfs/dbraw/zinc/21/95/02/205219502.db2.gz ZQBIFUUCWWJLSY-UHFFFAOYSA-N 1 1 392.503 3.447 10 0 GGAEMO Cc1cnc(C)c(-c2cc(O)c3c(c2)CN(CC[C@H]2CCC[N@@H+]2C)CCO3)n1 ZINC000067677141 205254721 /nfs/dbraw/zinc/25/47/21/205254721.db2.gz ZXUJUSVIULZSHP-LJQANCHMSA-N 1 1 382.508 3.145 10 0 GGAEMO Cn1ncc2c1nc(-c1ccccn1)nc2NC[C@@H]1CCC[N@H+]2CCCC[C@H]12 ZINC000072169368 205315859 /nfs/dbraw/zinc/31/58/59/205315859.db2.gz MDDURLGAOBPTTC-MAUKXSAKSA-N 1 1 377.496 3.102 10 0 GGAEMO CCOC(=O)Nc1ccc2c(CN(C)[C@H]3CC[N@@H+](C)[C@H](C)C3)cc(=O)oc2c1 ZINC000078876523 205376126 /nfs/dbraw/zinc/37/61/26/205376126.db2.gz OLVIIGDRYVWUFM-PBHICJAKSA-N 1 1 387.480 3.276 10 0 GGAEMO CCOC(=O)Nc1ccc2c(C[N@H+](C)[C@H]3CCN(C)[C@H](C)C3)cc(=O)oc2c1 ZINC000078876523 205376128 /nfs/dbraw/zinc/37/61/28/205376128.db2.gz OLVIIGDRYVWUFM-PBHICJAKSA-N 1 1 387.480 3.276 10 0 GGAEMO CCOC(=O)Nc1ccc2c(C[N@@H+](C)[C@H]3CCN(C)[C@H](C)C3)cc(=O)oc2c1 ZINC000078876523 205376132 /nfs/dbraw/zinc/37/61/32/205376132.db2.gz OLVIIGDRYVWUFM-PBHICJAKSA-N 1 1 387.480 3.276 10 0 GGAEMO CCn1c(C[NH+]2CCC3(CC2)Nc2ccccc2NC3=O)nc2ccccc21 ZINC000082092105 205386276 /nfs/dbraw/zinc/38/62/76/205386276.db2.gz ZJTKJRWIYJFXLS-UHFFFAOYSA-N 1 1 375.476 3.455 10 0 GGAEMO CC(=O)Nc1ccc(C2=NN(C(=O)C[NH+]3CCCC3)[C@@H](c3ccco3)C2)cc1 ZINC000225635075 206061979 /nfs/dbraw/zinc/06/19/79/206061979.db2.gz SCGVWLJGHDKATK-LJQANCHMSA-N 1 1 380.448 3.012 10 0 GGAEMO CC(C)OCCOCc1cccc(NC(=O)N(C)[C@@H]2CC[N@@H+](C)C[C@@H]2C)c1 ZINC000229444649 206105317 /nfs/dbraw/zinc/10/53/17/206105317.db2.gz OKZKMDVBTRPHKS-FXAWDEMLSA-N 1 1 377.529 3.432 10 0 GGAEMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000229627272 206107076 /nfs/dbraw/zinc/10/70/76/206107076.db2.gz GQZIMPIZMHHBKN-OAGGEKHMSA-N 1 1 394.313 3.199 10 0 GGAEMO CCOC(=O)Nc1ccc2c(CN(C)[C@H]3CC[N@@H+](C)[C@@H](C)C3)cc(=O)oc2c1 ZINC000229820798 206107376 /nfs/dbraw/zinc/10/73/76/206107376.db2.gz OLVIIGDRYVWUFM-YOEHRIQHSA-N 1 1 387.480 3.276 10 0 GGAEMO CCOC(=O)Nc1ccc2c(C[N@H+](C)[C@H]3CCN(C)[C@@H](C)C3)cc(=O)oc2c1 ZINC000229820798 206107380 /nfs/dbraw/zinc/10/73/80/206107380.db2.gz OLVIIGDRYVWUFM-YOEHRIQHSA-N 1 1 387.480 3.276 10 0 GGAEMO CCOC(=O)Nc1ccc2c(C[N@@H+](C)[C@H]3CCN(C)[C@@H](C)C3)cc(=O)oc2c1 ZINC000229820798 206107385 /nfs/dbraw/zinc/10/73/85/206107385.db2.gz OLVIIGDRYVWUFM-YOEHRIQHSA-N 1 1 387.480 3.276 10 0 GGAEMO CCOC(=O)Nc1ccc2c(CN(C)[C@@H]3CC[N@@H+](C)[C@@H](C)C3)cc(=O)oc2c1 ZINC000229820789 206108135 /nfs/dbraw/zinc/10/81/35/206108135.db2.gz OLVIIGDRYVWUFM-WMLDXEAASA-N 1 1 387.480 3.276 10 0 GGAEMO CCOC(=O)Nc1ccc2c(C[N@H+](C)[C@@H]3CCN(C)[C@@H](C)C3)cc(=O)oc2c1 ZINC000229820789 206108140 /nfs/dbraw/zinc/10/81/40/206108140.db2.gz OLVIIGDRYVWUFM-WMLDXEAASA-N 1 1 387.480 3.276 10 0 GGAEMO CCOC(=O)Nc1ccc2c(C[N@@H+](C)[C@@H]3CCN(C)[C@@H](C)C3)cc(=O)oc2c1 ZINC000229820789 206108144 /nfs/dbraw/zinc/10/81/44/206108144.db2.gz OLVIIGDRYVWUFM-WMLDXEAASA-N 1 1 387.480 3.276 10 0 GGAEMO Cc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@H](Oc3cccnc3N(C)C)C2)cc1F ZINC000253427202 206147299 /nfs/dbraw/zinc/14/72/99/206147299.db2.gz DORMKVKLVIABCW-WBVHZDCISA-N 1 1 386.471 3.075 10 0 GGAEMO Cc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@H](Oc3cccnc3N(C)C)C2)cc1F ZINC000253427202 206147304 /nfs/dbraw/zinc/14/73/04/206147304.db2.gz DORMKVKLVIABCW-WBVHZDCISA-N 1 1 386.471 3.075 10 0 GGAEMO CN(C)C(=O)C1CC[NH+]([C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)CC1 ZINC000043784694 206194871 /nfs/dbraw/zinc/19/48/71/206194871.db2.gz YIHXSUXTDDKYII-HXUWFJFHSA-N 1 1 383.467 3.306 10 0 GGAEMO CN(C)C(=O)C1CC[NH+]([C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)CC1 ZINC000043784692 206195976 /nfs/dbraw/zinc/19/59/76/206195976.db2.gz YIHXSUXTDDKYII-FQEVSTJZSA-N 1 1 383.467 3.306 10 0 GGAEMO CCC(=O)c1ccc(OC[C@H](O)C[NH+]2CCN(c3cccc(C)c3)CC2)cc1 ZINC000012553566 221205329 /nfs/dbraw/zinc/20/53/29/221205329.db2.gz VRKWFNCPVWQSSC-OAQYLSRUSA-N 1 1 382.504 3.150 10 0 GGAEMO c1[nH]c2ccccc2c1-c1nc2c(c(N3CCC([NH+]4CCCC4)CC3)n1)CNC2 ZINC000072167382 136167327 /nfs/dbraw/zinc/16/73/27/136167327.db2.gz PIESAQWZRBSGBR-UHFFFAOYSA-N 1 1 388.519 3.293 10 0 GGAEMO O=C(NCC[NH+]1CCN(c2ccccc2)CC1)c1cc2ccc3cccnc3c2[nH]1 ZINC000096319764 136186441 /nfs/dbraw/zinc/18/64/41/136186441.db2.gz JMGQQRMYQSCXIW-UHFFFAOYSA-N 1 1 399.498 3.268 10 0 GGAEMO COCc1cc(=O)[nH]c(-c2cccc(C[N@H+](C)Cc3nc4ccccc4o3)c2)n1 ZINC000023505468 522903029 /nfs/dbraw/zinc/90/30/29/522903029.db2.gz QPPJSYWGNDEDBN-UHFFFAOYSA-N 1 1 390.443 3.357 10 0 GGAEMO COCc1cc(=O)[nH]c(-c2cccc(C[N@@H+](C)Cc3nc4ccccc4o3)c2)n1 ZINC000023505468 522903040 /nfs/dbraw/zinc/90/30/40/522903040.db2.gz QPPJSYWGNDEDBN-UHFFFAOYSA-N 1 1 390.443 3.357 10 0 GGAEMO OC1CC[NH+](Cc2nnn(-c3ccc(F)c(Cl)c3)c2-c2ccncc2)CC1 ZINC000057345324 527516402 /nfs/dbraw/zinc/51/64/02/527516402.db2.gz OYGMNUBLRHBGPR-UHFFFAOYSA-N 1 1 387.846 3.079 10 0 GGAEMO CCc1cc(N2CCC([N@H+](C)Cc3ccccn3)CC2)nc(N2CCCC2)n1 ZINC000095528885 536144670 /nfs/dbraw/zinc/14/46/70/536144670.db2.gz XIYUZMUFDQEDNH-UHFFFAOYSA-N 1 1 380.540 3.135 10 0 GGAEMO CCc1cc(N2CCC([N@@H+](C)Cc3ccccn3)CC2)nc(N2CCCC2)n1 ZINC000095528885 536144675 /nfs/dbraw/zinc/14/46/75/536144675.db2.gz XIYUZMUFDQEDNH-UHFFFAOYSA-N 1 1 380.540 3.135 10 0 GGAEMO C[C@@H](CNc1ncnc2cccc(I)c21)[N@@H+](C)C1CC1 ZINC000545166367 564410833 /nfs/dbraw/zinc/41/08/33/564410833.db2.gz VGCIMRNIPQYSLH-JTQLQIEISA-N 1 1 382.249 3.129 10 0 GGAEMO Nc1c(Br)cc(Br)cc1CN1CC[N@H+]2CCC[C@H]2C1 ZINC000248767820 566088339 /nfs/dbraw/zinc/08/83/39/566088339.db2.gz HCHFGUZDBXZFGJ-LBPRGKRZSA-N 1 1 389.135 3.074 10 0 GGAEMO CC[N@H+]1CC[C@@H](CNC(=O)c2c(Cl)cccc2I)C1 ZINC000463514121 566414964 /nfs/dbraw/zinc/41/49/64/566414964.db2.gz BFOCZTZOQYXIMP-JTQLQIEISA-N 1 1 392.668 3.016 10 0 GGAEMO CCCN(CCC)C(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595929054 567592298 /nfs/dbraw/zinc/59/22/98/567592298.db2.gz HAQQTRYCDFOBTJ-UHFFFAOYSA-N 1 1 378.279 3.218 10 0 GGAEMO CC[N@@H+]1CCO[C@H](C(=O)Nc2cc(C)n(-c3ccc(Cl)c(Cl)c3)n2)C1 ZINC000538611989 564195119 /nfs/dbraw/zinc/19/51/19/564195119.db2.gz RLLCOAUSAJZIHJ-HNNXBMFYSA-N 1 1 383.279 3.147 10 0 GGAEMO CC[N@H+]1CCO[C@H](C(=O)Nc2cc(C)n(-c3ccc(Cl)c(Cl)c3)n2)C1 ZINC000538611989 564195123 /nfs/dbraw/zinc/19/51/23/564195123.db2.gz RLLCOAUSAJZIHJ-HNNXBMFYSA-N 1 1 383.279 3.147 10 0 GGAEMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)N[C@@H]1CCc2cc(Br)ccc21 ZINC000115808887 564199104 /nfs/dbraw/zinc/19/91/04/564199104.db2.gz OKELBUWMRGTACX-SUMWQHHRSA-N 1 1 380.330 3.420 10 0 GGAEMO C[C@@H](Cc1ccc(Br)cc1)NC(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000115803382 564199288 /nfs/dbraw/zinc/19/92/88/564199288.db2.gz NBGWOLLJMXYGEZ-HOCLYGCPSA-N 1 1 382.346 3.363 10 0 GGAEMO C[C@@H](Cc1ccc(Br)cc1)NC(=O)N(C)C[C@@H]1CCC[N@@H+](C)C1 ZINC000115803375 564199534 /nfs/dbraw/zinc/19/95/34/564199534.db2.gz NBGWOLLJMXYGEZ-GOEBONIOSA-N 1 1 382.346 3.363 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC(=O)c1cccc(Br)c1 ZINC000116249254 564206505 /nfs/dbraw/zinc/20/65/05/564206505.db2.gz QIDJAHGNKWXSIN-KSSFIOAISA-N 1 1 388.309 3.485 10 0 GGAEMO Cn1cc([C@H]2CC[N@H+](Cc3nc(-c4ccc(Br)s4)no3)C2)cn1 ZINC000116309649 564207469 /nfs/dbraw/zinc/20/74/69/564207469.db2.gz MJBVHSVXYGTWFO-JTQLQIEISA-N 1 1 394.298 3.284 10 0 GGAEMO Cn1cc([C@H]2CC[N@@H+](Cc3nc(-c4ccc(Br)s4)no3)C2)cn1 ZINC000116309649 564207475 /nfs/dbraw/zinc/20/74/75/564207475.db2.gz MJBVHSVXYGTWFO-JTQLQIEISA-N 1 1 394.298 3.284 10 0 GGAEMO Cn1cc([C@@H]2CC[N@@H+](CCC(=O)Nc3ccc(Br)cc3)C2)cn1 ZINC000116315791 564207513 /nfs/dbraw/zinc/20/75/13/564207513.db2.gz WNZMGJBXXNZVEG-CYBMUJFWSA-N 1 1 377.286 3.001 10 0 GGAEMO Cn1cc([C@@H]2CC[N@H+](Cc3nc(-c4ccc(Br)s4)no3)C2)cn1 ZINC000116309646 564207658 /nfs/dbraw/zinc/20/76/58/564207658.db2.gz MJBVHSVXYGTWFO-SNVBAGLBSA-N 1 1 394.298 3.284 10 0 GGAEMO Cn1cc([C@@H]2CC[N@@H+](Cc3nc(-c4ccc(Br)s4)no3)C2)cn1 ZINC000116309646 564207663 /nfs/dbraw/zinc/20/76/63/564207663.db2.gz MJBVHSVXYGTWFO-SNVBAGLBSA-N 1 1 394.298 3.284 10 0 GGAEMO CN(C[C@@H]1CC[N@@H+](C)C1)C(=O)c1cc(Br)sc1Br ZINC000116752109 564216115 /nfs/dbraw/zinc/21/61/15/564216115.db2.gz WROSVQKDYGTIKA-MRVPVSSYSA-N 1 1 396.148 3.297 10 0 GGAEMO CC[C@H]1CN(C(=O)c2cc3cc(Br)ccc3[nH]2)CC[N@@H+]1CCOC ZINC000117307701 564225112 /nfs/dbraw/zinc/22/51/12/564225112.db2.gz NRCKOAVPXMCFRC-HNNXBMFYSA-N 1 1 394.313 3.113 10 0 GGAEMO CC[C@H]1CN(C(=O)c2cc3cc(Br)ccc3[nH]2)CC[N@H+]1CCOC ZINC000117307701 564225115 /nfs/dbraw/zinc/22/51/15/564225115.db2.gz NRCKOAVPXMCFRC-HNNXBMFYSA-N 1 1 394.313 3.113 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)Nc2cc(Br)ccc2C)C[C@H]1C ZINC000117445359 564227201 /nfs/dbraw/zinc/22/72/01/564227201.db2.gz KUPVMDUNRGAKSR-CQSZACIVSA-N 1 1 384.318 3.332 10 0 GGAEMO 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Cc1ccc(NC(=O)c2ccnc(N3CC[NH+](C)CC3)c2)cc1Br ZINC000112271818 565061485 /nfs/dbraw/zinc/06/14/85/565061485.db2.gz BKTHJVOJGBHXEK-UHFFFAOYSA-N 1 1 389.297 3.157 10 0 GGAEMO Cc1c(Br)cccc1NC(=O)c1ccnc(N2CC[NH+](C)CC2)c1 ZINC000112284178 565061992 /nfs/dbraw/zinc/06/19/92/565061992.db2.gz NCDAUJORUKTVHM-UHFFFAOYSA-N 1 1 389.297 3.157 10 0 GGAEMO Cc1nc(C(=O)N2[C@H](C)C[N@@H+](C)C[C@@H]2C)nn1-c1c(Cl)cccc1Cl ZINC000155350232 565066438 /nfs/dbraw/zinc/06/64/38/565066438.db2.gz RUJNFGHVXPZTIB-PHIMTYICSA-N 1 1 382.295 3.047 10 0 GGAEMO Cc1nc(C(=O)N2[C@H](C)C[N@H+](C)C[C@@H]2C)nn1-c1c(Cl)cccc1Cl ZINC000155350232 565066439 /nfs/dbraw/zinc/06/64/39/565066439.db2.gz RUJNFGHVXPZTIB-PHIMTYICSA-N 1 1 382.295 3.047 10 0 GGAEMO CCOc1c(Br)cc(C(=O)N[C@@H]2C[N@H+](C(C)C)C[C@@H]2C)cc1OC ZINC000155386236 565067073 /nfs/dbraw/zinc/06/70/73/565067073.db2.gz WHGIKQSJRLJAPK-SWLSCSKDSA-N 1 1 399.329 3.315 10 0 GGAEMO Brc1ccc2ncnc(N3CCCC[C@H]3C[NH+]3CCOCC3)c2c1 ZINC000112967244 565067198 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Cc1cc(C)cc(NC(=O)C[NH2+][C@@H](CO)c2cccc(Br)c2)c1 ZINC000183913290 565104028 /nfs/dbraw/zinc/10/40/28/565104028.db2.gz GZMXCVAJJAXKPF-KRWDZBQOSA-N 1 1 377.282 3.328 10 0 GGAEMO C[N@H+]1CC[C@@]2(CCN(Cc3nc(-c4cccc(Br)c4)no3)C2)C1 ZINC000292185584 565103907 /nfs/dbraw/zinc/10/39/07/565103907.db2.gz QWWIIUIXBNYERJ-QGZVFWFLSA-N 1 1 377.286 3.027 10 0 GGAEMO C[N@H+]1CC[C@@]2(CCN(Cc3nnc(-c4ccccc4Br)o3)C2)C1 ZINC000292195647 565104378 /nfs/dbraw/zinc/10/43/78/565104378.db2.gz RTHZHMFDBVMZEB-QGZVFWFLSA-N 1 1 377.286 3.027 10 0 GGAEMO C[N@@H+](Cc1cc(Br)ccc1F)C1CCN(c2cnccn2)CC1 ZINC000369881125 565116777 /nfs/dbraw/zinc/11/67/77/565116777.db2.gz BIERCJCPQVREQY-UHFFFAOYSA-N 1 1 379.277 3.479 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(C(=O)c2cc3c(c(Br)c2)OCO3)CC1 ZINC000369874155 565117523 /nfs/dbraw/zinc/11/75/23/565117523.db2.gz ONXWHXWKXFEPHH-UHFFFAOYSA-N 1 1 392.253 3.160 10 0 GGAEMO C[N@@H+](C[C@H](O)c1ccc(Cl)cc1Cl)C1CCN(c2cnccn2)CC1 ZINC000370049326 565125237 /nfs/dbraw/zinc/12/52/37/565125237.db2.gz HYHBALFONCATBQ-KRWDZBQOSA-N 1 1 381.307 3.418 10 0 GGAEMO C[N@@H+](C[C@@H](O)c1ccc(Cl)cc1Cl)C1CCN(c2cnccn2)CC1 ZINC000370049327 565125531 /nfs/dbraw/zinc/12/55/31/565125531.db2.gz HYHBALFONCATBQ-QGZVFWFLSA-N 1 1 381.307 3.418 10 0 GGAEMO Cc1noc([C@@H]2CCC[N@@H+](C[C@@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292689004 565129502 /nfs/dbraw/zinc/12/95/02/565129502.db2.gz AHZYSMZYMYNEFF-SJKOYZFVSA-N 1 1 398.276 3.367 10 0 GGAEMO C[N@H+]1CC[C@]2(CCN(C(=O)N[C@H]3CCOc4c(Br)cccc43)C2)C1 ZINC000292742982 565131738 /nfs/dbraw/zinc/13/17/38/565131738.db2.gz TXEDWNILDYFDIJ-YJBOKZPZSA-N 1 1 394.313 3.010 10 0 GGAEMO C[N@H+]1CC[C@@]2(CCN(C(=O)N[C@H]3CCOc4c(Br)cccc43)C2)C1 ZINC000292740823 565131829 /nfs/dbraw/zinc/13/18/29/565131829.db2.gz TXEDWNILDYFDIJ-MAUKXSAKSA-N 1 1 394.313 3.010 10 0 GGAEMO O=S(=O)(NC1CC[NH+](CCC(Cl)(Cl)Cl)CC1)c1cccs1 ZINC000184404615 565133571 /nfs/dbraw/zinc/13/35/71/565133571.db2.gz BQSLQPSTRIWOHG-UHFFFAOYSA-N 1 1 391.773 3.251 10 0 GGAEMO CN(CCC[NH+]1CCN(C)CC1)C(=O)N[C@H]1CCCc2sc(Cl)cc21 ZINC000292834157 565137030 /nfs/dbraw/zinc/13/70/30/565137030.db2.gz BQRMCHXVBWAQSJ-HNNXBMFYSA-N 1 1 384.977 3.058 10 0 GGAEMO CC[C@H]1CN(C(=O)c2ccc(Br)c(Cl)c2)CC[N@H+]1C[C@@H](C)O ZINC000157613601 565138702 /nfs/dbraw/zinc/13/87/02/565138702.db2.gz UBNMJJJWNJMNTF-YPMHNXCESA-N 1 1 389.721 3.020 10 0 GGAEMO C[N@H+]1CCC[C@H]2CN(C(=O)c3c[nH]c4cccc(Br)c34)CC[C@@H]21 ZINC000157719872 565141938 /nfs/dbraw/zinc/14/19/38/565141938.db2.gz QTLBBQVTKOCGIF-LRDDRELGSA-N 1 1 376.298 3.487 10 0 GGAEMO COc1cc(C)c(Br)cc1NC(=O)N1C[C@@H]2CCC[N@H+]2C[C@@H]1C ZINC000184536759 565142897 /nfs/dbraw/zinc/14/28/97/565142897.db2.gz QXQJHVMKYLWCPO-STQMWFEESA-N 1 1 382.302 3.467 10 0 GGAEMO Cc1ccc(N2CCC(NC(=O)Cc3ccc(Br)cc3)CC2)[nH+]c1 ZINC000157775548 565143270 /nfs/dbraw/zinc/14/32/70/565143270.db2.gz SDAJJPLMFZWVJL-UHFFFAOYSA-N 1 1 388.309 3.480 10 0 GGAEMO C[C@@H]1CN(C(=O)Cc2csc3ccc(Cl)cc23)C[C@@H]1[NH+]1CCOCC1 ZINC000157860368 565146846 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Cc1c(Br)c2ccccc2n1CC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000370902999 565166866 /nfs/dbraw/zinc/16/68/66/565166866.db2.gz OMPCPRMUKQYBGN-LBPRGKRZSA-N 1 1 387.281 3.109 10 0 GGAEMO CC(C)Oc1cc(Br)ccc1C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000370903594 565167103 /nfs/dbraw/zinc/16/71/03/565167103.db2.gz VVZPTQNTPWVOAS-GFCCVEGCSA-N 1 1 378.270 3.247 10 0 GGAEMO C[N@@H+](CCCO)C1CCN(C(=O)N[C@@H]2CCCc3sc(Cl)cc32)CC1 ZINC000293432219 565168099 /nfs/dbraw/zinc/16/80/99/565168099.db2.gz OJXIWGIDODTUPH-OAHLLOKOSA-N 1 1 385.961 3.267 10 0 GGAEMO CCO[C@@H]1C[C@H](O)C12CC[NH+](Cc1nc3cc(Br)ccc3[nH]1)CC2 ZINC000184974114 565169486 /nfs/dbraw/zinc/16/94/86/565169486.db2.gz VNTZVAFLDONMOC-JKSUJKDBSA-N 1 1 394.313 3.077 10 0 GGAEMO C[C@H]1C[C@H](N(C)C(=O)Cc2c[nH]c3cc(Br)ccc23)CC[N@H+]1C ZINC000158450038 565170132 /nfs/dbraw/zinc/17/01/32/565170132.db2.gz ZDOQPQKSGQWRIG-SWLSCSKDSA-N 1 1 378.314 3.414 10 0 GGAEMO CCn1cnnc1C1CC[NH+](C[C@@H](O)c2ccc(F)c(Br)c2)CC1 ZINC000185006050 565170297 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GGAEMO Cc1cc2cc(S(=O)(=O)N(C)[C@@H]3CC[N@@H+](C)[C@@H](C)C3)ccc2nc1Cl ZINC000293527410 565174047 /nfs/dbraw/zinc/17/40/47/565174047.db2.gz PCVRPMCWWGGCGS-DZGCQCFKSA-N 1 1 381.929 3.300 10 0 GGAEMO Cn1cc(-c2cc(C[N@H+](C)[C@@H](CO)c3cccc(Br)c3)on2)cn1 ZINC000185045772 565174328 /nfs/dbraw/zinc/17/43/28/565174328.db2.gz IKBOAMCVLFSVPB-KRWDZBQOSA-N 1 1 391.269 3.003 10 0 GGAEMO Cn1cc(-c2cc(C[N@@H+](C)[C@@H](CO)c3cccc(Br)c3)on2)cn1 ZINC000185045772 565174331 /nfs/dbraw/zinc/17/43/31/565174331.db2.gz IKBOAMCVLFSVPB-KRWDZBQOSA-N 1 1 391.269 3.003 10 0 GGAEMO Cn1cc(-c2cc(C[N@H+](CCO)Cc3ccc(Cl)c(Cl)c3)on2)cn1 ZINC000185046116 565174416 /nfs/dbraw/zinc/17/44/16/565174416.db2.gz KJAOZYHKKUMDMB-UHFFFAOYSA-N 1 1 381.263 3.376 10 0 GGAEMO Cn1cc(-c2cc(C[N@@H+](CCO)Cc3ccc(Cl)c(Cl)c3)on2)cn1 ZINC000185046116 565174418 /nfs/dbraw/zinc/17/44/18/565174418.db2.gz KJAOZYHKKUMDMB-UHFFFAOYSA-N 1 1 381.263 3.376 10 0 GGAEMO CC(C)[N@@H+]1C[C@H](NC(=O)Cc2c[nH]c3cccc(Br)c23)[C@@H](C)C1 ZINC000158581360 565174803 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CC(C)[C@H]([NH2+]Cc1c(Br)cnn1C)c1ccc2c(c1)OCCO2 ZINC000278285114 565549696 /nfs/dbraw/zinc/54/96/96/565549696.db2.gz BFHMBMKPPOOALD-KRWDZBQOSA-N 1 1 380.286 3.441 10 0 GGAEMO C[C@H]1C[C@@H](NCc2c(Br)cnn2C)CC[N@H+]1Cc1ccccc1 ZINC000278328326 565552025 /nfs/dbraw/zinc/55/20/25/565552025.db2.gz FRCVVLNZYYIFNK-HOCLYGCPSA-N 1 1 377.330 3.325 10 0 GGAEMO C[C@H]1C[C@H](NCc2c(Br)cnn2C)CC[N@H+]1Cc1ccccc1 ZINC000278328319 565552248 /nfs/dbraw/zinc/55/22/48/565552248.db2.gz FRCVVLNZYYIFNK-GOEBONIOSA-N 1 1 377.330 3.325 10 0 GGAEMO C[C@@H]1C[C@H](NCc2c(Br)cnn2C)CC[N@H+]1Cc1ccccc1 ZINC000278328308 565552312 /nfs/dbraw/zinc/55/23/12/565552312.db2.gz FRCVVLNZYYIFNK-GDBMZVCRSA-N 1 1 377.330 3.325 10 0 GGAEMO Cc1ncsc1C[N@@H+](C)C[C@H]1CCN(C(=O)NCCc2ccsc2)C1 ZINC000190693511 565552510 /nfs/dbraw/zinc/55/25/10/565552510.db2.gz HQKRXJVBZWSGKQ-MRXNPFEDSA-N 1 1 378.567 3.219 10 0 GGAEMO CC[N@H+]1CC[C@@H](NC(=O)c2cc(Br)ccc2Br)C1 ZINC000390010967 565554868 /nfs/dbraw/zinc/55/48/68/565554868.db2.gz 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389.359 3.183 10 0 GGAEMO CC[C@H]1CN(C(=O)c2cc(Br)cn2C(C)C)CC[N@@H+]1CCOC ZINC000173550026 565565771 /nfs/dbraw/zinc/56/57/71/565565771.db2.gz SKUAZMRJGSXWRJ-HNNXBMFYSA-N 1 1 386.334 3.014 10 0 GGAEMO CC[C@H]1CN(C(=O)c2cc(Br)cn2C(C)C)CC[N@H+]1CCOC ZINC000173550026 565565775 /nfs/dbraw/zinc/56/57/75/565565775.db2.gz SKUAZMRJGSXWRJ-HNNXBMFYSA-N 1 1 386.334 3.014 10 0 GGAEMO CC[C@H]1CN(C(=O)[C@@H](C)c2ccc(Br)s2)CC[N@@H+]1CCOC ZINC000173550614 565566060 /nfs/dbraw/zinc/56/60/60/565566060.db2.gz ZCYSSKVZSUQGSB-STQMWFEESA-N 1 1 389.359 3.183 10 0 GGAEMO CC[C@H]1CN(C(=O)[C@@H](C)c2ccc(Br)s2)CC[N@H+]1CCOC ZINC000173550614 565566066 /nfs/dbraw/zinc/56/60/66/565566066.db2.gz ZCYSSKVZSUQGSB-STQMWFEESA-N 1 1 389.359 3.183 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)c2cc(Br)cn2C(C)C)C[C@@H]1C ZINC000173546324 565566153 /nfs/dbraw/zinc/56/61/53/565566153.db2.gz TUGGKWLHNLONPU-AWEZNQCLSA-N 1 1 386.334 3.014 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)c2cc(Br)cn2C(C)C)C[C@@H]1C ZINC000173546324 565566160 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Cn1ncc(Br)c1CNCC1CC[NH+](Cc2ccccc2)CC1 ZINC000397563142 565576034 /nfs/dbraw/zinc/57/60/34/565576034.db2.gz ZDARKSBBTFDJJV-UHFFFAOYSA-N 1 1 377.330 3.184 10 0 GGAEMO C[C@H]([NH2+]C1COCCOC1)c1ccc(Br)cc1Br ZINC000311030958 565579195 /nfs/dbraw/zinc/57/91/95/565579195.db2.gz CVNZCVWTMRMQNB-VIFPVBQESA-N 1 1 379.092 3.278 10 0 GGAEMO O=C(N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12)c1cc(Br)c[nH]1 ZINC000310410290 565579234 /nfs/dbraw/zinc/57/92/34/565579234.db2.gz MGJRDEITRUUNBF-HYVNUMGLSA-N 1 1 388.309 3.418 10 0 GGAEMO C[C@@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)[N@H+]1CC[C@@]2(CNC(=O)C2)C1 ZINC000278833853 565579285 /nfs/dbraw/zinc/57/92/85/565579285.db2.gz IPIQRURKKQRXFV-DYZYQPBXSA-N 1 1 381.263 3.316 10 0 GGAEMO CC[C@@H](NC(=O)N1CC[N@H+]2CCCC[C@@H]2C1)c1nc(C(F)(F)F)cs1 ZINC000173732908 565580757 /nfs/dbraw/zinc/58/07/57/565580757.db2.gz OXPPDNJXSKTXJG-VXGBXAGGSA-N 1 1 376.448 3.493 10 0 GGAEMO CCC[N@@H+](CC)CCNS(=O)(=O)c1c(Cl)cccc1Br ZINC000312936944 565583262 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C[C@H]1C[C@H](NC(=O)c2nscc2Br)C[N@H+]1Cc1ccccc1 ZINC000404817778 565584385 /nfs/dbraw/zinc/58/43/85/565584385.db2.gz QSQGLRDVJSCFBY-AAEUAGOBSA-N 1 1 380.311 3.298 10 0 GGAEMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1C(=O)c1c(Cl)cc(F)cc1Cl ZINC000278911261 565585004 /nfs/dbraw/zinc/58/50/04/565585004.db2.gz SXOZNDOBHQLDMY-LLVKDONJSA-N 1 1 375.271 3.458 10 0 GGAEMO C[C@@H]1C[C@@H](NC(=O)N[C@H]2CCOc3c(Br)cccc32)C[N@H+]1C1CC1 ZINC000407954835 565586989 /nfs/dbraw/zinc/58/69/89/565586989.db2.gz FNYRGRZATBURLX-HSMVNMDESA-N 1 1 394.313 3.197 10 0 GGAEMO CCC[N@@H+](C)C[C@@H]1CCN(C(=O)Cc2cc(Br)ccc2OC)C1 ZINC000173805831 565588500 /nfs/dbraw/zinc/58/85/00/565588500.db2.gz QACFIDIZSJVYRL-AWEZNQCLSA-N 1 1 383.330 3.191 10 0 GGAEMO CS(=O)(=O)N1CCC[C@H](C[N@@H+](CCC(F)(F)F)Cc2ccccc2)C1 ZINC000191241827 565590045 /nfs/dbraw/zinc/59/00/45/565590045.db2.gz ZHJUUXDNAFPAKF-MRXNPFEDSA-N 1 1 378.460 3.113 10 0 GGAEMO C[C@@H]1CN(C(=O)CCCSc2ccc(Cl)cc2)C[C@H]1[NH+]1CCOCC1 ZINC000173836385 565591809 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/nfs/dbraw/zinc/82/59/56/565825956.db2.gz KQBOGTYPSHPNNW-UHFFFAOYSA-N 1 1 395.341 3.346 10 0 GGAEMO CC1(C)CC[C@H](C(=O)NC2CC[NH+](Cc3cccc(Br)c3)CC2)O1 ZINC000412969408 565826259 /nfs/dbraw/zinc/82/62/59/565826259.db2.gz JMEIIGCCGHGBFB-QGZVFWFLSA-N 1 1 395.341 3.487 10 0 GGAEMO COc1cc(Br)c(NC(=O)N2C[C@H]3CCC[N@H+]3C[C@@H]2C)cc1OC ZINC000177147426 565831973 /nfs/dbraw/zinc/83/19/73/565831973.db2.gz BBJRKJQHUWMUNP-NWDGAFQWSA-N 1 1 398.301 3.167 10 0 GGAEMO C[C@@H]1COCC[C@H]1C(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000194705562 565832233 /nfs/dbraw/zinc/83/22/33/565832233.db2.gz NXDQGIFDRMMTEN-RDTXWAMCSA-N 1 1 395.341 3.202 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1ccccc1I ZINC000177195249 565834318 /nfs/dbraw/zinc/83/43/18/565834318.db2.gz MBYLRRGCYGBBKL-CYBMUJFWSA-N 1 1 395.244 3.101 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)[C@H](C)Oc1cccc(Br)c1 ZINC000177197523 565834560 /nfs/dbraw/zinc/83/45/60/565834560.db2.gz BBCMGGGWEYRIOO-BBRMVZONSA-N 1 1 392.297 3.413 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)[C@@H](C)Oc1ccccc1Br ZINC000177209480 565835537 /nfs/dbraw/zinc/83/55/37/565835537.db2.gz JRRJRZVHWQAOMD-UKRRQHHQSA-N 1 1 392.297 3.413 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)/C=C/c1c(Cl)nc2sccn12 ZINC000177214185 565835579 /nfs/dbraw/zinc/83/55/79/565835579.db2.gz BIZDJGPRIHVNKO-MUBLQREKSA-N 1 1 375.885 3.259 10 0 GGAEMO C[C@@H](NC(=O)N(C)CC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1Br ZINC000194808768 565839277 /nfs/dbraw/zinc/83/92/77/565839277.db2.gz PFZZEMCKAIWADS-QLFBSQMISA-N 1 1 398.345 3.261 10 0 GGAEMO C[C@@H](NC(=O)N(C)CC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1Br ZINC000194808768 565839283 /nfs/dbraw/zinc/83/92/83/565839283.db2.gz PFZZEMCKAIWADS-QLFBSQMISA-N 1 1 398.345 3.261 10 0 GGAEMO CC[N@H+]1CCC[C@@H](NC(=O)Nc2ccc(F)cc2I)C1 ZINC000177279263 565841072 /nfs/dbraw/zinc/84/10/72/565841072.db2.gz DBZMSNVMNCZKMP-LLVKDONJSA-N 1 1 391.228 3.036 10 0 GGAEMO C[C@@H](NC(=O)N(C)CC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc(Br)c1 ZINC000194838936 565842217 /nfs/dbraw/zinc/84/22/17/565842217.db2.gz YEWILTVVGSILRI-QLFBSQMISA-N 1 1 398.345 3.261 10 0 GGAEMO C[C@@H](NC(=O)N(C)CC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc(Br)c1 ZINC000194838936 565842224 /nfs/dbraw/zinc/84/22/24/565842224.db2.gz YEWILTVVGSILRI-QLFBSQMISA-N 1 1 398.345 3.261 10 0 GGAEMO Cc1ccc(C[NH+](C)C)cc1NC(=O)CS(=O)(=O)c1ccc(Cl)cc1 ZINC000177339177 565844734 /nfs/dbraw/zinc/84/47/34/565844734.db2.gz AMBCQEZTGLYMEP-UHFFFAOYSA-N 1 1 380.897 3.122 10 0 GGAEMO CCOC(=O)C1(O)CC[NH+](Cc2cnc(-c3ccc(Cl)cc3)s2)CC1 ZINC000284433824 565853631 /nfs/dbraw/zinc/85/36/31/565853631.db2.gz SETPJFXMGIXGBI-UHFFFAOYSA-N 1 1 380.897 3.354 10 0 GGAEMO COC(=O)c1ccc(C[NH2+][C@H]2CCCc3nn(C)cc32)c(Br)c1 ZINC000284464212 565854754 /nfs/dbraw/zinc/85/47/54/565854754.db2.gz VHGXBVSLEQTFBT-HNNXBMFYSA-N 1 1 378.270 3.136 10 0 GGAEMO COC(=O)c1ccc(C[NH2+][C@@H]2CCCc3nn(C)cc32)c(Br)c1 ZINC000284464216 565854799 /nfs/dbraw/zinc/85/47/99/565854799.db2.gz VHGXBVSLEQTFBT-OAHLLOKOSA-N 1 1 378.270 3.136 10 0 GGAEMO O=C(c1cc2c(cc(Br)cc2F)[nH]1)N1CC[N@@H+]2CCCC[C@@H]2C1 ZINC000195060998 565855624 /nfs/dbraw/zinc/85/56/24/565855624.db2.gz HXFDTVPWWWWKNL-GFCCVEGCSA-N 1 1 380.261 3.380 10 0 GGAEMO O=C(c1cc2c(cc(Br)cc2F)[nH]1)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000195060998 565855628 /nfs/dbraw/zinc/85/56/28/565855628.db2.gz HXFDTVPWWWWKNL-GFCCVEGCSA-N 1 1 380.261 3.380 10 0 GGAEMO CCOc1c(Br)cc(C(=O)N2CC[N@@H+]3CCCC[C@H]3C2)cc1OC ZINC000195074129 565857140 /nfs/dbraw/zinc/85/71/40/565857140.db2.gz DNLJUMLZCODHGU-AWEZNQCLSA-N 1 1 397.313 3.167 10 0 GGAEMO CCOc1c(Br)cc(C(=O)N2CC[N@H+]3CCCC[C@H]3C2)cc1OC ZINC000195074129 565857144 /nfs/dbraw/zinc/85/71/44/565857144.db2.gz DNLJUMLZCODHGU-AWEZNQCLSA-N 1 1 397.313 3.167 10 0 GGAEMO COc1ccc(CCC(=O)N2CC[N@H+]3CCCC[C@@H]3C2)cc1Br ZINC000195088592 565858082 /nfs/dbraw/zinc/85/80/82/565858082.db2.gz OVFXWMXGCZUWHQ-OAHLLOKOSA-N 1 1 381.314 3.087 10 0 GGAEMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000332898793 565858138 /nfs/dbraw/zinc/85/81/38/565858138.db2.gz LHPWMGSUYZSECM-DAXOMENPSA-N 1 1 396.329 3.301 10 0 GGAEMO COc1ccc(CCC(=O)N2CC[N@H+]3CCCC[C@H]3C2)cc1Br ZINC000195088610 565858604 /nfs/dbraw/zinc/85/86/04/565858604.db2.gz OVFXWMXGCZUWHQ-HNNXBMFYSA-N 1 1 381.314 3.087 10 0 GGAEMO CNC(=O)Cc1nc(C[NH2+]C2(c3ccc(Br)cc3)CCC2)cs1 ZINC000177578547 565861302 /nfs/dbraw/zinc/86/13/02/565861302.db2.gz QNGGPIDNQYSOOM-UHFFFAOYSA-N 1 1 394.338 3.363 10 0 GGAEMO C[C@H](NC(=O)N1CC[NH+](CCCOCC(F)(F)F)CC1)c1cccs1 ZINC000195229936 565867297 /nfs/dbraw/zinc/86/72/97/565867297.db2.gz SAAFFIOTORYDCG-ZDUSSCGKSA-N 1 1 379.448 3.105 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CN(C)CC(=O)Nc1c(F)cc(F)cc1Br ZINC000177709435 565869325 /nfs/dbraw/zinc/86/93/25/565869325.db2.gz YSARGMFWQSIBBD-LBPRGKRZSA-N 1 1 390.272 3.082 10 0 GGAEMO COC(=O)c1sccc1CN1CC[C@H](C[N@@H+](C)Cc2scnc2C)C1 ZINC000195260954 565870721 /nfs/dbraw/zinc/87/07/21/565870721.db2.gz JAXFNNFWWXYUEF-CQSZACIVSA-N 1 1 379.551 3.254 10 0 GGAEMO Brc1cccc(Cc2noc(CN3CC[N@H+]4CCCC[C@@H]4C3)n2)c1 ZINC000177755906 565871280 /nfs/dbraw/zinc/87/12/80/565871280.db2.gz UANAIVGLMFHAOG-MRXNPFEDSA-N 1 1 391.313 3.093 10 0 GGAEMO Cc1ccc(Cc2nc([C@H]3C[N@@H+]4CCC[C@@H]4CO3)no2)c(Br)c1 ZINC000333215849 565871424 /nfs/dbraw/zinc/87/14/24/565871424.db2.gz UWTIUSNGVMWWLF-UKRRQHHQSA-N 1 1 378.270 3.267 10 0 GGAEMO Cc1ccc(Cc2nc([C@H]3C[N@H+]4CCC[C@@H]4CO3)no2)c(Br)c1 ZINC000333215849 565871428 /nfs/dbraw/zinc/87/14/28/565871428.db2.gz UWTIUSNGVMWWLF-UKRRQHHQSA-N 1 1 378.270 3.267 10 0 GGAEMO Cc1cc(Br)cc(C)c1NC(=O)N1C[C@@H](C)[C@H]([NH+]2CCOCC2)C1 ZINC000177760449 565872427 /nfs/dbraw/zinc/87/24/27/565872427.db2.gz FBEAZWVPAXXRKP-GDBMZVCRSA-N 1 1 396.329 3.250 10 0 GGAEMO O=C(COc1ccc(C2SCCCS2)cc1)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000195318976 565875555 /nfs/dbraw/zinc/87/55/55/565875555.db2.gz RBIKPKUZYIWIIP-MRXNPFEDSA-N 1 1 378.563 3.241 10 0 GGAEMO CC[N@@H+](C)C[C@H]1CCN(C(=O)N[C@@H](C)Cc2ccc(Br)cc2)C1 ZINC000177857419 565878125 /nfs/dbraw/zinc/87/81/25/565878125.db2.gz AUOTYNIUJOGYQL-GOEBONIOSA-N 1 1 382.346 3.363 10 0 GGAEMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NS(=O)(=O)CCc2cccs2)cc1 ZINC000195392944 565878874 /nfs/dbraw/zinc/87/88/74/565878874.db2.gz BCMHPKRRLPCBCJ-CQSZACIVSA-N 1 1 375.519 3.465 10 0 GGAEMO C[N@H+]1CCC[C@@H](CNS(=O)(=O)CCc2cccs2)[C@@H]1c1cccs1 ZINC000195384381 565879246 /nfs/dbraw/zinc/87/92/46/565879246.db2.gz WKKQUTNFGSPHNK-WMLDXEAASA-N 1 1 384.592 3.355 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000177978552 565885383 /nfs/dbraw/zinc/88/53/83/565885383.db2.gz TZKZTOZQYCFYRT-CYBMUJFWSA-N 1 1 381.263 3.128 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000177978544 565886072 /nfs/dbraw/zinc/88/60/72/565886072.db2.gz TZKZTOZQYCFYRT-ZDUSSCGKSA-N 1 1 381.263 3.128 10 0 GGAEMO C[C@@H](NC(=O)C[NH+]1CCC(c2cc[nH]n2)CC1)c1ccc(Br)cc1 ZINC000195506187 565888872 /nfs/dbraw/zinc/88/88/72/565888872.db2.gz ZDZJVKNOJNXXLP-CYBMUJFWSA-N 1 1 391.313 3.229 10 0 GGAEMO Cn1nccc1C1CC[NH+](Cc2cc3c(c(Br)c2)OCO3)CC1 ZINC000195504039 565889441 /nfs/dbraw/zinc/88/94/41/565889441.db2.gz ZPVZVGKAAHAZBN-UHFFFAOYSA-N 1 1 378.270 3.291 10 0 GGAEMO O[C@H](COc1ccc(Br)c(F)c1)C[N@H+]1CCc2ccccc2C1 ZINC000200437647 565895164 /nfs/dbraw/zinc/89/51/64/565895164.db2.gz LXXJLRYGDXPPDB-HNNXBMFYSA-N 1 1 380.257 3.386 10 0 GGAEMO O=C(c1ccc(Br)cc1Br)N1CC[NH+](C2CC2)CC1 ZINC000218774946 565900602 /nfs/dbraw/zinc/90/06/02/565900602.db2.gz GKVZABCUCKPEJP-UHFFFAOYSA-N 1 1 388.103 3.132 10 0 GGAEMO C[C@H](Cn1cc(Br)ccc1=O)N[C@@H](C[NH+](C)C)c1ccc(F)cc1 ZINC000414162903 565900615 /nfs/dbraw/zinc/90/06/15/565900615.db2.gz MKUQNOVDZITWKO-DYVFJYSZSA-N 1 1 396.304 3.031 10 0 GGAEMO C[C@H](Cn1cc(Br)ccc1=O)N[C@H](C[NH+](C)C)c1ccc(F)cc1 ZINC000414162902 565900794 /nfs/dbraw/zinc/90/07/94/565900794.db2.gz MKUQNOVDZITWKO-CXAGYDPISA-N 1 1 396.304 3.031 10 0 GGAEMO C[N@H+]1CCC[C@@H](NC(=O)c2ccc(Br)cc2Br)C1 ZINC000218767660 565900887 /nfs/dbraw/zinc/90/08/87/565900887.db2.gz UQGUXGPVYJUDNW-SNVBAGLBSA-N 1 1 376.092 3.036 10 0 GGAEMO O=C(c1ccc(Br)cc1Br)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000218773978 565901024 /nfs/dbraw/zinc/90/10/24/565901024.db2.gz XGLKFOHBBVBHKH-LLVKDONJSA-N 1 1 388.103 3.132 10 0 GGAEMO COCCNC(=O)C1([NH2+][C@@H](C)c2cc3cc(Br)ccc3o2)CC1 ZINC000414187714 565901806 /nfs/dbraw/zinc/90/18/06/565901806.db2.gz QNKRHDRXAZZUDH-NSHDSACASA-N 1 1 381.270 3.141 10 0 GGAEMO O=c1ccc2c([nH]1)CCC[C@H]2[NH2+]Cc1ncc(I)s1 ZINC000285352532 565902709 /nfs/dbraw/zinc/90/27/09/565902709.db2.gz DQFVAOFQEXOCNO-SECBINFHSA-N 1 1 387.246 3.016 10 0 GGAEMO C[NH+](C)C1(CN[C@@H]2CCCOc3ccc(Br)cc32)CCOCC1 ZINC000178224803 565906628 /nfs/dbraw/zinc/90/66/28/565906628.db2.gz ZBCAYRUTHYUWLE-MRXNPFEDSA-N 1 1 383.330 3.363 10 0 GGAEMO C[C@](CO)([NH2+]Cc1cc(F)cc2c1OCOC2)c1ccc(Br)cc1 ZINC000285454779 565909179 /nfs/dbraw/zinc/90/91/79/565909179.db2.gz MNAHMIPVYUDYRJ-GOSISDBHSA-N 1 1 396.256 3.452 10 0 GGAEMO C[C@@](CO)([NH2+]Cc1cc(F)cc2c1OCOC2)c1ccc(Br)cc1 ZINC000285454784 565909281 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C[C@H](C[NH2+][C@H]1CCCOc2ccc(Br)cc21)CN1CCN(C)CC1 ZINC000178689336 565933424 /nfs/dbraw/zinc/93/34/24/565933424.db2.gz ZUOMOQSRDBIZSV-QAPCUYQASA-N 1 1 396.373 3.136 10 0 GGAEMO CN(CCOCC[N@H+](C)Cc1ccc(Cl)nc1)Cc1ccc(Cl)nc1 ZINC000178710331 565934081 /nfs/dbraw/zinc/93/40/81/565934081.db2.gz PWXAITKAPVVYED-UHFFFAOYSA-N 1 1 383.323 3.364 10 0 GGAEMO CN(CCOCC[N@@H+](C)Cc1ccc(Cl)nc1)Cc1ccc(Cl)nc1 ZINC000178710331 565934088 /nfs/dbraw/zinc/93/40/88/565934088.db2.gz PWXAITKAPVVYED-UHFFFAOYSA-N 1 1 383.323 3.364 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)NCCc2ccc(Br)s2)[C@H](C)C1 ZINC000178690094 565934234 /nfs/dbraw/zinc/93/42/34/565934234.db2.gz ZQMUAVFJSYQRLL-TZMCWYRMSA-N 1 1 388.375 3.425 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1CC(=O)Nc1ccc(C)cc1Br ZINC000178751830 565936374 /nfs/dbraw/zinc/93/63/74/565936374.db2.gz RTQMGZXMUXSNJT-OAHLLOKOSA-N 1 1 391.313 3.366 10 0 GGAEMO Cc1ccc(C[N@H+]2CC[C@@H](Cc3cccc(I)c3)C2)nn1 ZINC000414459123 565936615 /nfs/dbraw/zinc/93/66/15/565936615.db2.gz 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C[NH+](C)C[C@@H](NS(=O)(=O)C[C@@H]1CCCCO1)c1ccc(Cl)c(Cl)c1 ZINC000625535743 566332667 /nfs/dbraw/zinc/33/26/67/566332667.db2.gz UVZQICVHQZVMTK-XJKSGUPXSA-N 1 1 395.352 3.085 10 0 GGAEMO CNC(=O)[C@H]1CC[N@@H+](Cc2csc(-c3cccc(Br)c3)n2)C1 ZINC000420970533 566332976 /nfs/dbraw/zinc/33/29/76/566332976.db2.gz GNEZKGDBOZFTCH-LBPRGKRZSA-N 1 1 380.311 3.141 10 0 GGAEMO COc1ccc(Br)cc1C1(NC(=O)[C@H]2CC[N@@H+](C)[C@@H](C)C2)CC1 ZINC000648958105 566335044 /nfs/dbraw/zinc/33/50/44/566335044.db2.gz ZSHDQUIMLXURIR-STQMWFEESA-N 1 1 381.314 3.293 10 0 GGAEMO C[N@H+]1CCC[C@@H]1CNC(=O)c1c(F)ccc(C(F)(F)F)c1Br ZINC000625566431 566337209 /nfs/dbraw/zinc/33/72/09/566337209.db2.gz MKEVYUALWOUWFO-MRVPVSSYSA-N 1 1 383.183 3.431 10 0 GGAEMO O=C(Nc1nncs1)C1CC[NH+](Cc2cc(F)cc(Br)c2)CC1 ZINC000482832861 566337783 /nfs/dbraw/zinc/33/77/83/566337783.db2.gz COOVRYRUINOMQQ-UHFFFAOYSA-N 1 1 399.289 3.290 10 0 GGAEMO Cc1cnn(CC[N@@H+](CCc2ccc(Cl)cc2)C[C@@H](O)C(F)(F)F)c1 ZINC000576379596 566340278 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CCn1nccc1C[N@@H+](CCO)CCC(=O)Nc1c(Cl)cccc1Cl ZINC000482914942 566342993 /nfs/dbraw/zinc/34/29/93/566342993.db2.gz OPPHRMZIOLCVTQ-UHFFFAOYSA-N 1 1 385.295 3.033 10 0 GGAEMO C[C@@H]([NH2+]CC(=O)N1CCC[C@H](C(F)(F)F)C1)c1ccc(Br)cn1 ZINC000482953237 566343903 /nfs/dbraw/zinc/34/39/03/566343903.db2.gz BIPYRZCMNJNJLR-MNOVXSKESA-N 1 1 394.235 3.296 10 0 GGAEMO C[C@H]([NH2+]CC(=O)N1CCC[C@@H](C(F)(F)F)C1)c1ccc(Br)cn1 ZINC000482953243 566344059 /nfs/dbraw/zinc/34/40/59/566344059.db2.gz BIPYRZCMNJNJLR-WDEREUQCSA-N 1 1 394.235 3.296 10 0 GGAEMO C[C@@H]([NH2+]CC(=O)Nc1nc2c(s1)CCCC2)c1ccc(Br)cn1 ZINC000482964739 566346268 /nfs/dbraw/zinc/34/62/68/566346268.db2.gz SPMVMKPYFVTMEV-SNVBAGLBSA-N 1 1 395.326 3.469 10 0 GGAEMO CN(C(=O)c1cc(-c2ccc(Br)cc2)n[nH]1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000600570333 566347144 /nfs/dbraw/zinc/34/71/44/566347144.db2.gz AMADSZDFBALHHL-OAHLLOKOSA-N 1 1 389.297 3.148 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CN1CCN(Cc2cc(F)cc(Br)c2)CC1 ZINC000482976933 566347199 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O=C([C@@H]1CCC[N@H+](Cc2cc(Br)cc3c2OCC3)C1)N1CCCC1 ZINC000462786730 566352897 /nfs/dbraw/zinc/35/28/97/566352897.db2.gz BECJUSVKCWKVGQ-OAHLLOKOSA-N 1 1 393.325 3.218 10 0 GGAEMO Cc1ccncc1C[N@@H+](C)C[C@H](O)COc1cc(F)cc(Br)c1 ZINC000483026501 566353369 /nfs/dbraw/zinc/35/33/69/566353369.db2.gz LOFYIBPCOWFQQE-INIZCTEOSA-N 1 1 383.261 3.163 10 0 GGAEMO CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000510024569 566357116 /nfs/dbraw/zinc/35/71/16/566357116.db2.gz VZENNTJAZYNCAF-WOSRLPQWSA-N 1 1 385.961 3.097 10 0 GGAEMO Cc1[nH+]ccn1CCCCNC(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000625788206 566357491 /nfs/dbraw/zinc/35/74/91/566357491.db2.gz OISIWKZINAENRO-BPQIPLTHSA-N 1 1 388.309 3.436 10 0 GGAEMO O=C(C[N@H+]1CC[C@H]2CC[C@@H](C1)S2)NCc1ccc(F)cc1C(F)(F)F ZINC000625772637 566357745 /nfs/dbraw/zinc/35/77/45/566357745.db2.gz FULOBFOYXFJYGN-KGLIPLIRSA-N 1 1 376.419 3.431 10 0 GGAEMO C[N@H+]1CC[C@@H](NS(=O)(=O)CCc2cccc(Cl)c2)[C@@H]1c1ccccc1 ZINC000510021035 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C[C@H]1OCC[C@H]1[N@@H+](CCO)Cc1ncc(-c2ccccc2Br)o1 ZINC000483268632 566369266 /nfs/dbraw/zinc/36/92/66/566369266.db2.gz PANQCMZTBUNEAP-IUODEOHRSA-N 1 1 381.270 3.076 10 0 GGAEMO CC(=O)N[C@@H]1CC[N@@H+](Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000421397269 566370108 /nfs/dbraw/zinc/37/01/08/566370108.db2.gz XPFNGYKXMZEKON-CQSZACIVSA-N 1 1 380.311 3.283 10 0 GGAEMO C[NH+](C)C[C@H](NCC(=O)NC(C1CC1)C1CC1)c1ccc(Cl)c(Cl)c1 ZINC000625983704 566371953 /nfs/dbraw/zinc/37/19/53/566371953.db2.gz YGUAKGSLAWYPCP-KRWDZBQOSA-N 1 1 384.351 3.491 10 0 GGAEMO O=C(NC1CC[NH+](Cc2ccc(Br)cc2)CC1)[C@H]1C[C@@H]1C(F)F ZINC000510285565 566372042 /nfs/dbraw/zinc/37/20/42/566372042.db2.gz GOWFHJPBPRHMBW-GJZGRUSLSA-N 1 1 387.268 3.431 10 0 GGAEMO CC(C)C[N@H+]1CCO[C@H](CNC(=O)CSCc2cccc(F)c2Cl)C1 ZINC000557197764 566372084 /nfs/dbraw/zinc/37/20/84/566372084.db2.gz SWUDHVSFIIHNPK-OAHLLOKOSA-N 1 1 388.936 3.185 10 0 GGAEMO CC[C@](C)([NH2+]Cc1ccc(S(=O)(=O)NC2CC2)cc1)c1nc(C)cs1 ZINC000649562396 566372257 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CO[C@H](C(=O)NC[C@H]1CC[N@H+]1C1CCCC1)c1ccccc1Br ZINC000628966453 566599196 /nfs/dbraw/zinc/59/91/96/566599196.db2.gz UVWIVSMOUGGVMB-PBHICJAKSA-N 1 1 381.314 3.270 10 0 GGAEMO Cn1ncc(Br)c1C(=O)Nc1nc2c(s1)C[N@H+](C(C)(C)C)CC2 ZINC000425035022 566599413 /nfs/dbraw/zinc/59/94/13/566599413.db2.gz HDHFZDQERXZYLE-UHFFFAOYSA-N 1 1 398.330 3.048 10 0 GGAEMO CC(C)C[N@@H+]1CC[C@@H](CNC[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000579344171 566601082 /nfs/dbraw/zinc/60/10/82/566601082.db2.gz VEOGPUQFUDINDK-GJZGRUSLSA-N 1 1 375.340 3.301 10 0 GGAEMO CC(C)C[N@H+]1CC[C@@H](CNC[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000579344171 566601086 /nfs/dbraw/zinc/60/10/86/566601086.db2.gz VEOGPUQFUDINDK-GJZGRUSLSA-N 1 1 375.340 3.301 10 0 GGAEMO C[C@H]1C[N@@H+](CCO)CCN1Cc1csc(-c2cccc(Br)c2)n1 ZINC000449785886 566601288 /nfs/dbraw/zinc/60/12/88/566601288.db2.gz JRINYMFDFNIXLX-ZDUSSCGKSA-N 1 1 396.354 3.071 10 0 GGAEMO CSc1cccc(C(=O)N2CC[NH+](CCCOCC(F)(F)F)CC2)c1 ZINC000449800775 566602399 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GGAEMO CN(Cc1cc(Br)c2c(c1)OCCCO2)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000513466267 566604266 /nfs/dbraw/zinc/60/42/66/566604266.db2.gz BZYBGHWSMUMSMK-OAHLLOKOSA-N 1 1 381.314 3.279 10 0 GGAEMO CN(Cc1cc(Br)c2c(c1)OCCCO2)[C@H]1CC[N@H+](C2CC2)C1 ZINC000513466266 566604349 /nfs/dbraw/zinc/60/43/49/566604349.db2.gz BZYBGHWSMUMSMK-HNNXBMFYSA-N 1 1 381.314 3.279 10 0 GGAEMO CCCOc1c(Cl)cc(C[N@H+](C)C[C@@H]2CCS(=O)(=O)C2)cc1OCC ZINC000539819492 566604816 /nfs/dbraw/zinc/60/48/16/566604816.db2.gz DGWQUGSMYDMNKB-AWEZNQCLSA-N 1 1 389.945 3.394 10 0 GGAEMO CCCOc1c(Cl)cc(C[N@@H+](C)C[C@@H]2CCS(=O)(=O)C2)cc1OCC ZINC000539819492 566604826 /nfs/dbraw/zinc/60/48/26/566604826.db2.gz DGWQUGSMYDMNKB-AWEZNQCLSA-N 1 1 389.945 3.394 10 0 GGAEMO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCCN2CCOc2ccccc2Br)C1 ZINC000652364012 566605903 /nfs/dbraw/zinc/60/59/03/566605903.db2.gz VCNHZXABEWIWIE-HFTRVMKXSA-N 1 1 383.330 3.189 10 0 GGAEMO CCNC(=O)C[C@@H]1CCCC[N@H+]1CCOc1cc(F)cc(Br)c1 ZINC000560176572 566606888 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O=C(CC[N@H+]1C[C@H](O)C[C@H]1[C@H]1CCCOC1)Nc1c(Cl)cccc1Cl ZINC000560272155 566613279 /nfs/dbraw/zinc/61/32/79/566613279.db2.gz QZTJCFLQTJTMAR-ZENOOKHLSA-N 1 1 387.307 3.184 10 0 GGAEMO C[C@H](CNC(=O)c1ccc2scc(Br)c2c1)C[NH+]1CCOCC1 ZINC000449911129 566614787 /nfs/dbraw/zinc/61/47/87/566614787.db2.gz HSNSPQFHGCCEDQ-GFCCVEGCSA-N 1 1 397.338 3.362 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CN1CCN(Cc2ccc(Br)cc2F)CC1 ZINC000513647010 566615611 /nfs/dbraw/zinc/61/56/11/566615611.db2.gz DUUHDEMATHVKOX-KRWDZBQOSA-N 1 1 384.337 3.190 10 0 GGAEMO C[N@H+]1CCCC[C@@H]1CN1CCN(Cc2ccc(F)c(Br)c2)CC1 ZINC000513673767 566615628 /nfs/dbraw/zinc/61/56/28/566615628.db2.gz WWUZLFLNITTZHV-MRXNPFEDSA-N 1 1 384.337 3.190 10 0 GGAEMO CC(C)C[N@@H+](C)CCCNC(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O ZINC000652522740 566616161 /nfs/dbraw/zinc/61/61/61/566616161.db2.gz VCSQUMMOJKTBLL-MRXNPFEDSA-N 1 1 383.945 3.237 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CN1CCN(Cc2ccc(F)c(Br)c2)CC1 ZINC000513673766 566616146 /nfs/dbraw/zinc/61/61/46/566616146.db2.gz WWUZLFLNITTZHV-INIZCTEOSA-N 1 1 384.337 3.190 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)c2cccc(NC(N)=O)c2)cc1Br ZINC000467013410 566616328 /nfs/dbraw/zinc/61/63/28/566616328.db2.gz JFXSMDVVHWKBJV-UHFFFAOYSA-N 1 1 391.269 3.254 10 0 GGAEMO O=C(CCCC[NH+]1CCOCC1)NC1(c2ccccc2Br)CCC1 ZINC000652515719 566616319 /nfs/dbraw/zinc/61/63/19/566616319.db2.gz KWBDAWHRSJGCDH-UHFFFAOYSA-N 1 1 395.341 3.447 10 0 GGAEMO CCc1nnc(C)cc1C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000467019263 566616978 /nfs/dbraw/zinc/61/69/78/566616978.db2.gz WCSVGYQXJRUJGL-UHFFFAOYSA-N 1 1 377.286 3.424 10 0 GGAEMO C[C@H](c1ccccc1Br)[N@H+]1CCC[C@@H](C(=O)N2CCOCC2)C1 ZINC000513683847 566617536 /nfs/dbraw/zinc/61/75/36/566617536.db2.gz NDADAJDBVKQMPW-HUUCEWRRSA-N 1 1 381.314 3.081 10 0 GGAEMO CCN(CC)C(=O)CCC(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000467031562 566617723 /nfs/dbraw/zinc/61/77/23/566617723.db2.gz JBUXQCZXEJCWHY-UHFFFAOYSA-N 1 1 384.318 3.098 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)[C@@H]2COc3ccccc3O2)cc1Br ZINC000467024020 566617934 /nfs/dbraw/zinc/61/79/34/566617934.db2.gz SCOVPTKIBAXDNI-KRWDZBQOSA-N 1 1 391.265 3.289 10 0 GGAEMO NS(=O)(=O)C[C@H]1CCC[N@H+]1Cc1cccc(Oc2ccc(Cl)cc2)c1 ZINC000674908991 566617955 /nfs/dbraw/zinc/61/79/55/566617955.db2.gz VONBKAFUYLAGIE-MRXNPFEDSA-N 1 1 380.897 3.385 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CN1CCN(Cc2ccc(F)cc2Br)CC1 ZINC000513707954 566618203 /nfs/dbraw/zinc/61/82/03/566618203.db2.gz KUEPAOOEOBHEEM-KRWDZBQOSA-N 1 1 384.337 3.190 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)CNC(=O)CC(C)(C)C)cc1Br ZINC000467024806 566618246 /nfs/dbraw/zinc/61/82/46/566618246.db2.gz QAWXUABZYKWOEF-UHFFFAOYSA-N 1 1 384.318 3.002 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)c2ccc3c(c2)OCO3)cc1Br ZINC000467028273 566618548 /nfs/dbraw/zinc/61/85/48/566618548.db2.gz HLNTWUAYVSSZIV-UHFFFAOYSA-N 1 1 377.238 3.492 10 0 GGAEMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)CSCc1cc(-c2cccs2)on1 ZINC000467037746 566619869 /nfs/dbraw/zinc/61/98/69/566619869.db2.gz ZDVYALOPDGQNJL-SWLSCSKDSA-N 1 1 377.535 3.235 10 0 GGAEMO CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]Cc3nc4ccc(Br)cc4[nH]3)[C@@H]2C1 ZINC000579577386 566620216 /nfs/dbraw/zinc/62/02/16/566620216.db2.gz VMRIVKKKINXJIR-NWANDNLSSA-N 1 1 391.313 3.062 10 0 GGAEMO CC(=O)N1C[C@@H]2CCC[C@@H]([NH2+]Cc3nc4ccc(Br)cc4[nH]3)[C@H]2C1 ZINC000579577384 566620848 /nfs/dbraw/zinc/62/08/48/566620848.db2.gz VMRIVKKKINXJIR-AEGPPILISA-N 1 1 391.313 3.062 10 0 GGAEMO COC(=O)[C@@H]1CCC[C@@H](C(=O)Nc2ccc(C[NH+](C)C)c(Br)c2)C1 ZINC000467055407 566620886 /nfs/dbraw/zinc/62/08/86/566620886.db2.gz AFZOSUVPXDYMEF-CHWSQXEVSA-N 1 1 397.313 3.429 10 0 GGAEMO CC(=O)NCCCCCC(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000467045787 566621205 /nfs/dbraw/zinc/62/12/05/566621205.db2.gz LOHYSRIRESHBOC-UHFFFAOYSA-N 1 1 384.318 3.146 10 0 GGAEMO COC(=O)[C@H]1CCC[C@H](C(=O)Nc2ccc(C[NH+](C)C)c(Br)c2)C1 ZINC000467055410 566621260 /nfs/dbraw/zinc/62/12/60/566621260.db2.gz AFZOSUVPXDYMEF-STQMWFEESA-N 1 1 397.313 3.429 10 0 GGAEMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)N1CCc2cccc(Br)c2C1 ZINC000605882965 566621296 /nfs/dbraw/zinc/62/12/96/566621296.db2.gz OKKUHRGWVLXRKU-HNNXBMFYSA-N 1 1 378.314 3.001 10 0 GGAEMO CC(=O)N[C@@H](CC(C)C)C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000467048708 566621495 /nfs/dbraw/zinc/62/14/95/566621495.db2.gz FLTADVPPYCZTKL-INIZCTEOSA-N 1 1 384.318 3.000 10 0 GGAEMO Cn1nc(C(=O)Nc2ccc(C[NH+](C)C)c(Br)c2)cc1C1CC1 ZINC000467056405 566621556 /nfs/dbraw/zinc/62/15/56/566621556.db2.gz HMHYHMZLCUIWSH-UHFFFAOYSA-N 1 1 377.286 3.374 10 0 GGAEMO C[C@@H](OC[C@H]1CCCO1)C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000467057274 566621595 /nfs/dbraw/zinc/62/15/95/566621595.db2.gz DKYAHRKQZLMTSH-IUODEOHRSA-N 1 1 385.302 3.033 10 0 GGAEMO CN(C)c1cc(C(=O)Nc2ccc(C[NH+](C)C)c(Br)c2)ccn1 ZINC000467060234 566622341 /nfs/dbraw/zinc/62/23/41/566622341.db2.gz OQZKOZGBSGYUBD-UHFFFAOYSA-N 1 1 377.286 3.224 10 0 GGAEMO CC(C)C[N@H+]1CCO[C@@H](CNC(=O)CNc2cc(Cl)c(Cl)cc2F)C1 ZINC000486779190 566622888 /nfs/dbraw/zinc/62/28/88/566622888.db2.gz YNYDVWGQYLKDMQ-LBPRGKRZSA-N 1 1 392.302 3.017 10 0 GGAEMO C[C@H](OC[C@@H]1CCCO1)C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000467057278 566622908 /nfs/dbraw/zinc/62/29/08/566622908.db2.gz DKYAHRKQZLMTSH-WFASDCNBSA-N 1 1 385.302 3.033 10 0 GGAEMO CC[C@H](CNC(=O)N[C@H]1CCC[N@@H+](C)C1)Cc1cccc(Br)c1 ZINC000605961579 566622882 /nfs/dbraw/zinc/62/28/82/566622882.db2.gz RYEGUHNOLUMTDD-YOEHRIQHSA-N 1 1 382.346 3.411 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)[C@@H]2CCCc3n[nH]cc32)cc1Br ZINC000467076642 566623501 /nfs/dbraw/zinc/62/35/01/566623501.db2.gz XAGMZCKCFQEKDG-CYBMUJFWSA-N 1 1 377.286 3.292 10 0 GGAEMO O=C(C[N@@H+]1CCCN(CCc2cc(Cl)ccc2Cl)CC1)N1CCCC1 ZINC000486801491 566624122 /nfs/dbraw/zinc/62/41/22/566624122.db2.gz ULRJPEGPNVQILK-UHFFFAOYSA-N 1 1 384.351 3.166 10 0 GGAEMO CCN(CC)C(=O)C[N@H+]1CCCN(CCc2cc(Cl)ccc2Cl)CC1 ZINC000486798151 566624313 /nfs/dbraw/zinc/62/43/13/566624313.db2.gz KGKBSERZZHOUGA-UHFFFAOYSA-N 1 1 386.367 3.412 10 0 GGAEMO CC[C@@H](Cc1ccccc1Br)C(=O)NC[C@H]1CCC[N@H+]1CCOC ZINC000467097931 566625172 /nfs/dbraw/zinc/62/51/72/566625172.db2.gz 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396.329 3.098 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)C(=O)NCCC2=CCCC2)cc1Br ZINC000467241463 566636246 /nfs/dbraw/zinc/63/62/46/566636246.db2.gz JVDZMKWCHWCZNQ-UHFFFAOYSA-N 1 1 394.313 3.066 10 0 GGAEMO COCCOc1ccc([C@H](C)[NH2+]Cc2c(Br)cnn2C)cc1OC ZINC000486926327 566636698 /nfs/dbraw/zinc/63/66/98/566636698.db2.gz IOUBDPOSTTXXFN-LBPRGKRZSA-N 1 1 398.301 3.067 10 0 GGAEMO COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000467289735 566637958 /nfs/dbraw/zinc/63/79/58/566637958.db2.gz DUPFOZUSZOEPFW-WFTWPBCJSA-N 1 1 388.291 3.007 10 0 GGAEMO COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000467289735 566637963 /nfs/dbraw/zinc/63/79/63/566637963.db2.gz DUPFOZUSZOEPFW-WFTWPBCJSA-N 1 1 388.291 3.007 10 0 GGAEMO COCC[N@H+](Cc1ccc(S(=O)(=O)N(C)C)s1)[C@H](C)c1ccccc1 ZINC000425395307 566638181 /nfs/dbraw/zinc/63/81/81/566638181.db2.gz HMKRENAVNNWXSA-OAHLLOKOSA-N 1 1 382.551 3.208 10 0 GGAEMO COCC[N@@H+](Cc1ccc(S(=O)(=O)N(C)C)s1)[C@H](C)c1ccccc1 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385.295 3.204 10 0 GGAEMO Cc1cc(Br)cc2c1CN(C(=O)N[C@H]1CC[N@@H+](CC3CC3)C1)CC2 ZINC000678720437 566813396 /nfs/dbraw/zinc/81/33/96/566813396.db2.gz SYEOEKPWNSAORS-KRWDZBQOSA-N 1 1 392.341 3.310 10 0 GGAEMO Brc1cccc([C@@H]([NH2+]Cc2nnc3n2CCOC3)C2CCC2)c1 ZINC000631620933 566813620 /nfs/dbraw/zinc/81/36/20/566813620.db2.gz LCCULFHHBMHADU-KRWDZBQOSA-N 1 1 377.286 3.202 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CCC(=O)NC(C)(C)COc1ncccc1Br ZINC000517243160 566814417 /nfs/dbraw/zinc/81/44/17/566814417.db2.gz REIDDMJKMNSGNS-AWEZNQCLSA-N 1 1 398.345 3.382 10 0 GGAEMO C[C@@H]([NH2+]CC(=O)N1CCOC[C@H]1C1CC1)c1cc(F)c(Cl)cc1Cl ZINC000678729083 566815283 /nfs/dbraw/zinc/81/52/83/566815283.db2.gz WYCCWKAEHOWOES-HWPZZCPQSA-N 1 1 375.271 3.421 10 0 GGAEMO C[C@H]([NH2+]CC(=O)N1CCOC[C@@H]1C1CC1)c1cc(F)c(Cl)cc1Cl ZINC000678729084 566815370 /nfs/dbraw/zinc/81/53/70/566815370.db2.gz WYCCWKAEHOWOES-MGPLVRAMSA-N 1 1 375.271 3.421 10 0 GGAEMO COC(=O)c1ccc(Br)cc1C[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451415699 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GGAEMO CCOc1ccc(NC(=O)C[NH2+][C@@H](CO)c2cccc(Br)c2)cc1 ZINC000542911430 566837301 /nfs/dbraw/zinc/83/73/01/566837301.db2.gz DHKXKMGNTZRHKW-KRWDZBQOSA-N 1 1 393.281 3.110 10 0 GGAEMO CCc1ccc(CNC(=O)C[NH2+][C@H](CO)c2cccc(Br)c2)s1 ZINC000542915094 566837774 /nfs/dbraw/zinc/83/77/74/566837774.db2.gz ZPZNJDQABAZGEZ-MRXNPFEDSA-N 1 1 397.338 3.012 10 0 GGAEMO C[C@@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)[N@H+]1CCC[C@@H](C)C1 ZINC000517643358 566837762 /nfs/dbraw/zinc/83/77/62/566837762.db2.gz WXBZEPXPCSBTFQ-NEPJUHHUSA-N 1 1 379.302 3.176 10 0 GGAEMO C[C@@H](CNC(=O)c1n[nH]c2ccc(Br)cc21)[N@@H+]1CCC[C@@H](C)C1 ZINC000517643358 566837768 /nfs/dbraw/zinc/83/77/68/566837768.db2.gz WXBZEPXPCSBTFQ-NEPJUHHUSA-N 1 1 379.302 3.176 10 0 GGAEMO C[C@@H](CNC(=O)c1n[nH]c2ccc(Br)cc21)[N@H+]1CCC[C@@H](C)C1 ZINC000517643358 566837771 /nfs/dbraw/zinc/83/77/71/566837771.db2.gz WXBZEPXPCSBTFQ-NEPJUHHUSA-N 1 1 379.302 3.176 10 0 GGAEMO C[C@H](CNC(=O)c1[nH]nc2ccc(Br)cc21)[N@H+]1CCC[C@H](C)C1 ZINC000517643359 566837889 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VJFFHTLYCHOYFN-XQQFMLRXSA-N 1 1 393.329 3.422 10 0 GGAEMO C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000517641581 566838104 /nfs/dbraw/zinc/83/81/04/566838104.db2.gz VJFFHTLYCHOYFN-UPJWGTAASA-N 1 1 393.329 3.422 10 0 GGAEMO C[C@H](c1ccccc1)N(C)C(=O)C[NH2+][C@@H](CO)c1cccc(Br)c1 ZINC000542912501 566838085 /nfs/dbraw/zinc/83/80/85/566838085.db2.gz ZIFCBIMMBAKSRY-KDOFPFPSSA-N 1 1 391.309 3.292 10 0 GGAEMO CCc1ccc(CNC(=O)C[NH2+][C@@H](CO)c2cccc(Br)c2)s1 ZINC000542915092 566838223 /nfs/dbraw/zinc/83/82/23/566838223.db2.gz ZPZNJDQABAZGEZ-INIZCTEOSA-N 1 1 397.338 3.012 10 0 GGAEMO Brc1ccc(-c2nc(CN[C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)n[nH]2)cc1 ZINC000562959596 566838973 /nfs/dbraw/zinc/83/89/73/566838973.db2.gz YSAPPUSWYMYGKX-OWCLPIDISA-N 1 1 390.329 3.245 10 0 GGAEMO Brc1ccc(-c2n[nH]c(CN[C@@H]3CCC[C@@H]3[C@@H]3CCC[NH2+]3)n2)cc1 ZINC000562959596 566838979 /nfs/dbraw/zinc/83/89/79/566838979.db2.gz YSAPPUSWYMYGKX-OWCLPIDISA-N 1 1 390.329 3.245 10 0 GGAEMO Brc1ccc2c(c1)C=C(C[N@@H+]1CCO[C@@]3(CCSC3)C1)CO2 ZINC000582182064 566838922 /nfs/dbraw/zinc/83/89/22/566838922.db2.gz ODOKZDMDGWVMHQ-KRWDZBQOSA-N 1 1 382.323 3.433 10 0 GGAEMO Brc1ccc2c(c1)C=C(C[N@H+]1CCO[C@@]3(CCSC3)C1)CO2 ZINC000582182064 566838928 /nfs/dbraw/zinc/83/89/28/566838928.db2.gz ODOKZDMDGWVMHQ-KRWDZBQOSA-N 1 1 382.323 3.433 10 0 GGAEMO O=C(c1c(F)cncc1Br)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000632012226 566839485 /nfs/dbraw/zinc/83/94/85/566839485.db2.gz NIINPTVHIXSYRX-ABAIWWIYSA-N 1 1 382.277 3.072 10 0 GGAEMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000610538597 566839903 /nfs/dbraw/zinc/83/99/03/566839903.db2.gz GGGXSQKMVITKJZ-OLZOCXBDSA-N 1 1 390.307 3.397 10 0 GGAEMO C[N@H+]1CCC[C@H](CNS(=O)(=O)C[C@H]2CCC2(F)F)[C@H]1c1cccs1 ZINC000632027622 566841961 /nfs/dbraw/zinc/84/19/61/566841961.db2.gz IZXQJWORZQEVIF-NFAWXSAZSA-N 1 1 378.510 3.096 10 0 GGAEMO Cc1c(Br)c2ccccc2n1CC(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000517696723 566842375 /nfs/dbraw/zinc/84/23/75/566842375.db2.gz AJJYMVZDTFPMJU-OAHLLOKOSA-N 1 1 390.325 3.407 10 0 GGAEMO C[C@H]1C[C@@H](NS(=O)(=O)c2ccc(C(F)(F)C(F)(F)F)cc2)CC[N@H+]1C ZINC000632030406 566843817 /nfs/dbraw/zinc/84/38/17/566843817.db2.gz RLUSNHAEPVNNTJ-JQWIXIFHSA-N 1 1 386.386 3.102 10 0 GGAEMO C[C@@H]1C[N@@H+](CCCNC(=O)c2cc3c(cccc3Br)[nH]2)CCCO1 ZINC000470066181 566843992 /nfs/dbraw/zinc/84/39/92/566843992.db2.gz MSLVPHZCEXYVJN-CYBMUJFWSA-N 1 1 394.313 3.161 10 0 GGAEMO O=C(c1ccc(Br)cc1C(F)(F)F)N1CC[NH2+]C[C@H]1C(F)F ZINC000582236197 566844472 /nfs/dbraw/zinc/84/44/72/566844472.db2.gz GLCZTVLEPMMHKC-JTQLQIEISA-N 1 1 387.146 3.147 10 0 GGAEMO COc1cc(Br)ccc1[C@H](C)NC1CC[NH+]([C@H]2CCOC2)CC1 ZINC000655757749 566844680 /nfs/dbraw/zinc/84/46/80/566844680.db2.gz KQIXVLNLYPWJCQ-BBRMVZONSA-N 1 1 383.330 3.362 10 0 GGAEMO COc1cc(Br)ccc1[C@H](C)NC1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000655757752 566844927 /nfs/dbraw/zinc/84/49/27/566844927.db2.gz KQIXVLNLYPWJCQ-XJKSGUPXSA-N 1 1 383.330 3.362 10 0 GGAEMO C[N@H+]1CCC[C@H](NC(=O)c2coc(-c3ccc(Br)cc3F)n2)C1 ZINC000679302714 566846573 /nfs/dbraw/zinc/84/65/73/566846573.db2.gz FVSBXSWXMKLYQI-NSHDSACASA-N 1 1 382.233 3.067 10 0 GGAEMO CC(C)(CO)[NH+]1CCN(C(=O)c2cc(Br)cc3ccccc32)CC1 ZINC000679314920 566847100 /nfs/dbraw/zinc/84/71/00/566847100.db2.gz MMMPTMNTOMGXFK-UHFFFAOYSA-N 1 1 391.309 3.131 10 0 GGAEMO C[C@H](Cc1ccsc1)[N@H+]1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1 ZINC000543056869 566848767 /nfs/dbraw/zinc/84/87/67/566848767.db2.gz BAXMVLRFPMVPLF-OAHLLOKOSA-N 1 1 382.526 3.215 10 0 GGAEMO C[N@H+]1CC[C@@H](NC(=O)c2c(F)cncc2Br)[C@H]1c1ccccc1 ZINC000632159626 566856194 /nfs/dbraw/zinc/85/61/94/566856194.db2.gz JAVUZJJZALQDIC-GDBMZVCRSA-N 1 1 378.245 3.158 10 0 GGAEMO CC[N@@H+](CCC1CCN(S(=O)(=O)C[C@@H]2CCC2(F)F)CC1)CC1CC1 ZINC000632174059 566858102 /nfs/dbraw/zinc/85/81/02/566858102.db2.gz QNSDEHUJGZAVKK-KRWDZBQOSA-N 1 1 378.529 3.196 10 0 GGAEMO O[C@H](COC[C@H]1CCCO1)C[N@H+]1CCC[C@@H]1c1ccc(Br)s1 ZINC000543176821 566859768 /nfs/dbraw/zinc/85/97/68/566859768.db2.gz MIXSCPBMMBXNPN-BFHYXJOUSA-N 1 1 390.343 3.204 10 0 GGAEMO Cc1[nH+]cn(CCCCc2noc(-c3nn(C)cc3Br)n2)c1C ZINC000656039705 566866777 /nfs/dbraw/zinc/86/67/77/566866777.db2.gz ZQULJDSWPRHAFI-UHFFFAOYSA-N 1 1 379.262 3.069 10 0 GGAEMO Cc1[nH+]cn(CCCCc2noc(CCn3cc(Br)cn3)n2)c1C ZINC000656036929 566867406 /nfs/dbraw/zinc/86/74/06/566867406.db2.gz NNMNCERGMLSABP-UHFFFAOYSA-N 1 1 393.289 3.108 10 0 GGAEMO C[NH+](C)[C@@H](CNC(=O)N1CCC[C@H](OC(F)F)C1)c1ccccc1Cl ZINC000679680814 566867954 /nfs/dbraw/zinc/86/79/54/566867954.db2.gz WBSLCWJWDSIYNN-WFASDCNBSA-N 1 1 375.847 3.356 10 0 GGAEMO Cc1cc(OC[C@@H](O)C[N@H+]2CCSC[C@H]2CCO)c(C(C)C)cc1Cl ZINC000470367199 566868175 /nfs/dbraw/zinc/86/81/75/566868175.db2.gz MIDZVVYJCROKGN-CVEARBPZSA-N 1 1 387.973 3.311 10 0 GGAEMO COc1cc(C)nc(C[NH2+]CC(=O)Nc2ccc(Br)cc2C)c1 ZINC000563253751 566868620 /nfs/dbraw/zinc/86/86/20/566868620.db2.gz DNDOPNSYXPVCGH-UHFFFAOYSA-N 1 1 378.270 3.198 10 0 GGAEMO COc1cc(Br)ccc1[C@H](C)NC(=O)[C@@H]1CCc2c[nH+]c(C)n2C1 ZINC000563259293 566868997 /nfs/dbraw/zinc/86/89/97/566868997.db2.gz SWUIWHIRJYXUPP-WCQYABFASA-N 1 1 392.297 3.402 10 0 GGAEMO CC[NH+](CC)[C@H](C(=O)Nc1c[nH]cc(Br)c1=O)c1ccccc1 ZINC000518146500 566869014 /nfs/dbraw/zinc/86/90/14/566869014.db2.gz MHKQSECUKYOJAE-HNNXBMFYSA-N 1 1 378.270 3.159 10 0 GGAEMO Brc1ccccc1-n1cc(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)nn1 ZINC000582518117 566870545 /nfs/dbraw/zinc/87/05/45/566870545.db2.gz ILQATHSFCREFQX-LSDHHAIUSA-N 1 1 391.313 3.278 10 0 GGAEMO Brc1ccccc1-n1cc(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)nn1 ZINC000582518116 566870758 /nfs/dbraw/zinc/87/07/58/566870758.db2.gz ILQATHSFCREFQX-HUUCEWRRSA-N 1 1 391.313 3.278 10 0 GGAEMO CN(C)CC[NH+]1CCC(Nc2nc3ccccc3cc2Br)CC1 ZINC000656108072 566870953 /nfs/dbraw/zinc/87/09/53/566870953.db2.gz MFGJUUYUVIDGFE-UHFFFAOYSA-N 1 1 377.330 3.435 10 0 GGAEMO C[C@@H]1COCCC[N@H+]1CCCOc1cccc(I)c1 ZINC000610991001 566878593 /nfs/dbraw/zinc/87/85/93/566878593.db2.gz XPOHVZUCRNHYNO-CYBMUJFWSA-N 1 1 375.250 3.171 10 0 GGAEMO COc1cc(Br)ccc1C[NH2+][C@@H]1CCN(C2CCCCC2)C1=O ZINC000679771696 566873486 /nfs/dbraw/zinc/87/34/86/566873486.db2.gz JNNIOTMGPPJEJZ-MRXNPFEDSA-N 1 1 381.314 3.481 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)c2nnc(-c3ccc(Br)cc3)n2C)[C@@H](C)C1 ZINC000518261643 566873537 /nfs/dbraw/zinc/87/35/37/566873537.db2.gz NAXIOFJAHSFPHT-BBRMVZONSA-N 1 1 392.345 3.411 10 0 GGAEMO CN(Cc1ccccc1Br)C(=O)C[N@@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000428738288 566874425 /nfs/dbraw/zinc/87/44/25/566874425.db2.gz NWKLIUCGOCTCNX-ZBFHGGJFSA-N 1 1 387.268 3.385 10 0 GGAEMO CN(Cc1ccccc1Br)C(=O)C[N@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000428738288 566874432 /nfs/dbraw/zinc/87/44/32/566874432.db2.gz NWKLIUCGOCTCNX-ZBFHGGJFSA-N 1 1 387.268 3.385 10 0 GGAEMO Cc1cc(Br)cc(C)c1NC(=O)CCC[N@@H+](CC(N)=O)CC(C)C ZINC000679815769 566874334 /nfs/dbraw/zinc/87/43/34/566874334.db2.gz DESVFPAYHRVPHD-UHFFFAOYSA-N 1 1 398.345 3.228 10 0 GGAEMO Cc1cc(Br)cc(C)c1NC(=O)CCC[N@@H+]1CC[C@H]([C@@H](C)O)C1 ZINC000679823081 566875104 /nfs/dbraw/zinc/87/51/04/566875104.db2.gz HLCNWQSCBDMYAK-CABCVRRESA-N 1 1 383.330 3.487 10 0 GGAEMO COC[C@H]1C[N@@H+](CCCC(=O)Nc2c(C)cc(Br)cc2C)CCO1 ZINC000679819368 566875268 /nfs/dbraw/zinc/87/52/68/566875268.db2.gz NSLLCQGRMUJIIO-MRXNPFEDSA-N 1 1 399.329 3.132 10 0 GGAEMO COCC[N@H+]1CC[C@H](Nc2ccc(CCn3cc(Br)cn3)cc2)C1 ZINC000543396701 566877449 /nfs/dbraw/zinc/87/74/49/566877449.db2.gz VZNVCMHLCVJKQQ-SFHVURJKSA-N 1 1 393.329 3.021 10 0 GGAEMO C[N@H+]1CCC[C@@H](CCNC(=O)N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000582591470 566878073 /nfs/dbraw/zinc/87/80/73/566878073.db2.gz WUVYVSSQMJZNQZ-XJKSGUPXSA-N 1 1 396.329 3.304 10 0 GGAEMO COc1ccc(CSC[C@@H]2C[N@H+](C)CCO2)c(Br)c1OC ZINC000582605768 566878722 /nfs/dbraw/zinc/87/87/22/566878722.db2.gz RZMIXZIOBPTUSZ-LBPRGKRZSA-N 1 1 376.316 3.030 10 0 GGAEMO COc1ccc(CSC[C@@H]2C[N@@H+](C)CCO2)c(Br)c1OC ZINC000582605768 566878724 /nfs/dbraw/zinc/87/87/24/566878724.db2.gz RZMIXZIOBPTUSZ-LBPRGKRZSA-N 1 1 376.316 3.030 10 0 GGAEMO C[C@H](NC(=O)c1c(F)cncc1Br)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000632370424 566879191 /nfs/dbraw/zinc/87/91/91/566879191.db2.gz ZRCXCMXTMZIOSR-RYUDHWBXSA-N 1 1 384.293 3.366 10 0 GGAEMO C[C@H](NC(=O)[C@@H]1C[C@@]1(C)c1cccc(Br)c1)C1=CC[N@@H+](C)CC1 ZINC000632367619 566879436 /nfs/dbraw/zinc/87/94/36/566879436.db2.gz RSOZNZMCZNQDSD-IXDGSTSKSA-N 1 1 377.326 3.493 10 0 GGAEMO C[C@H](NC(=O)[C@@H]1C[C@]1(C)c1cccc(Br)c1)C1=CC[N@@H+](C)CC1 ZINC000632367620 566879538 /nfs/dbraw/zinc/87/95/38/566879538.db2.gz RSOZNZMCZNQDSD-SOVGHPHASA-N 1 1 377.326 3.493 10 0 GGAEMO C[C@@H](CNC(=O)c1n[nH]c2ccc(Br)cc21)C[NH+]1CCCCC1 ZINC000518357568 566879797 /nfs/dbraw/zinc/87/97/97/566879797.db2.gz XTJJAFONPYWFJN-LBPRGKRZSA-N 1 1 379.302 3.177 10 0 GGAEMO C[C@H](NC(=O)[C@H]1C[C@@]1(C)c1cccc(Br)c1)C1=CC[N@@H+](C)CC1 ZINC000632367618 566879894 /nfs/dbraw/zinc/87/98/94/566879894.db2.gz RSOZNZMCZNQDSD-IRWQIABSSA-N 1 1 377.326 3.493 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)c2cc(=O)[nH]c(C3CC3)n2)cc1Br ZINC000563389251 566880442 /nfs/dbraw/zinc/88/04/42/566880442.db2.gz VKQSLOLHFKDDCO-UHFFFAOYSA-N 1 1 391.269 3.136 10 0 GGAEMO CCOC(=O)[C@@H]1CCC[C@@H]1[NH2+]Cc1nnc(-c2ccccc2Br)o1 ZINC000451783523 566881140 /nfs/dbraw/zinc/88/11/40/566881140.db2.gz BPMJJZOYVSPABH-OCCSQVGLSA-N 1 1 394.269 3.321 10 0 GGAEMO CC(C)[N@@H+]1CCc2nc(NC(=O)c3c(F)cncc3Br)sc2C1 ZINC000632407609 566881586 /nfs/dbraw/zinc/88/15/86/566881586.db2.gz YOKNALVVWQNITM-UHFFFAOYSA-N 1 1 399.289 3.459 10 0 GGAEMO CC(C)[N@H+]1CCc2nc(NC(=O)c3c(F)cncc3Br)sc2C1 ZINC000632407609 566881590 /nfs/dbraw/zinc/88/15/90/566881590.db2.gz YOKNALVVWQNITM-UHFFFAOYSA-N 1 1 399.289 3.459 10 0 GGAEMO Cc1cn2cc(CC(=O)Nc3nc4c(s3)C[N@H+](C(C)C)CC4)nc2s1 ZINC000632407161 566881765 /nfs/dbraw/zinc/88/17/65/566881765.db2.gz KANQZSSPCXTPBX-UHFFFAOYSA-N 1 1 375.523 3.108 10 0 GGAEMO Cc1cn2cc(CC(=O)Nc3nc4c(s3)C[N@@H+](C(C)C)CC4)nc2s1 ZINC000632407161 566881772 /nfs/dbraw/zinc/88/17/72/566881772.db2.gz KANQZSSPCXTPBX-UHFFFAOYSA-N 1 1 375.523 3.108 10 0 GGAEMO CS(=O)(=O)CC[C@H]1CCCC[N@@H+]1CCOc1cccc(Br)c1 ZINC000428871950 566886444 /nfs/dbraw/zinc/88/64/44/566886444.db2.gz MPMXVRHORHLQII-OAHLLOKOSA-N 1 1 390.343 3.117 10 0 GGAEMO CS(=O)(=O)CC[C@H]1CCCC[N@H+]1CCOc1cccc(Br)c1 ZINC000428871950 566886448 /nfs/dbraw/zinc/88/64/48/566886448.db2.gz MPMXVRHORHLQII-OAHLLOKOSA-N 1 1 390.343 3.117 10 0 GGAEMO NC(=O)C[C@H]1CCCC[N@H+]1CCOc1ccc(Cl)cc1Br ZINC000518471733 566886596 /nfs/dbraw/zinc/88/65/96/566886596.db2.gz VRXNICWVUJJIFV-GFCCVEGCSA-N 1 1 375.694 3.211 10 0 GGAEMO Cc1nn(-c2cccc(Br)c2)cc1C[N@@H+]1C[C@@H](C(N)=O)CC[C@H]1C ZINC000656249797 566888048 /nfs/dbraw/zinc/88/80/48/566888048.db2.gz CKEVQMODSOUKQF-OCCSQVGLSA-N 1 1 391.313 3.029 10 0 GGAEMO Cc1nn(-c2cccc(Br)c2)cc1C[N@@H+]1C[C@@H](C(N)=O)CC[C@@H]1C ZINC000656249795 566888243 /nfs/dbraw/zinc/88/82/43/566888243.db2.gz CKEVQMODSOUKQF-JSGCOSHPSA-N 1 1 391.313 3.029 10 0 GGAEMO CN([C@@H]1C[NH+]2CCC1CC2)S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000632478616 566888989 /nfs/dbraw/zinc/88/89/89/566888989.db2.gz LIVSGQJDWANEIS-CYBMUJFWSA-N 1 1 382.835 3.074 10 0 GGAEMO CCc1nnc(CN2CCC[C@@H]([N@H+](C)Cc3nnc(CC)s3)CC2)s1 ZINC000680070351 566889506 /nfs/dbraw/zinc/88/95/06/566889506.db2.gz YICQLSAEIHDCAM-CYBMUJFWSA-N 1 1 380.587 3.001 10 0 GGAEMO CCc1nnc(CN2CCC[C@@H]([N@@H+](C)Cc3nnc(CC)s3)CC2)s1 ZINC000680070351 566889511 /nfs/dbraw/zinc/88/95/11/566889511.db2.gz YICQLSAEIHDCAM-CYBMUJFWSA-N 1 1 380.587 3.001 10 0 GGAEMO COCC[N@@H+](C)CCCNC(=O)c1cc(Br)cc2ccccc21 ZINC000518547702 566890489 /nfs/dbraw/zinc/89/04/89/566890489.db2.gz SUISBSGXNIRIME-UHFFFAOYSA-N 1 1 379.298 3.300 10 0 GGAEMO Cc1nn(-c2ccccc2Br)cc1C[N@@H+]1C[C@H](C(N)=O)CC[C@@H]1C ZINC000656250616 566890675 /nfs/dbraw/zinc/89/06/75/566890675.db2.gz WLJMKJQBFBIXFN-GXTWGEPZSA-N 1 1 391.313 3.029 10 0 GGAEMO COC(=O)C[C@](C)([NH2+]Cc1cc(C)ncn1)c1ccc(Br)cc1 ZINC000428944173 566892020 /nfs/dbraw/zinc/89/20/20/566892020.db2.gz RZFUGIKQDKUMIM-KRWDZBQOSA-N 1 1 378.270 3.116 10 0 GGAEMO COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)CC(F)(F)C[NH3+] ZINC000518553589 566892094 /nfs/dbraw/zinc/89/20/94/566892094.db2.gz IAZYHNXMYDNOBS-LBPRGKRZSA-N 1 1 377.229 3.105 10 0 GGAEMO COCC[N@H+](Cc1cn(-c2cccc(Br)c2)nc1C)[C@H]1CCOC1 ZINC000656257921 566892338 /nfs/dbraw/zinc/89/23/38/566892338.db2.gz MISCRRDYBROJPJ-SFHVURJKSA-N 1 1 394.313 3.181 10 0 GGAEMO COCC[N@@H+](Cc1cn(-c2cccc(Br)c2)nc1C)[C@H]1CCOC1 ZINC000656257921 566892344 /nfs/dbraw/zinc/89/23/44/566892344.db2.gz MISCRRDYBROJPJ-SFHVURJKSA-N 1 1 394.313 3.181 10 0 GGAEMO Cc1nn(-c2cccc(Br)c2)cc1CN1CC[C@@H]2C[N@H+](C)C[C@H]21 ZINC000656260055 566892613 /nfs/dbraw/zinc/89/26/13/566892613.db2.gz IHLWLLPJHPTWLX-RDTXWAMCSA-N 1 1 375.314 3.079 10 0 GGAEMO Cc1nn(-c2ccccc2Br)cc1CN1CC[C@H]2C[N@H+](C)C[C@H]21 ZINC000656259803 566893639 /nfs/dbraw/zinc/89/36/39/566893639.db2.gz CSJIKCJTNXRLMD-KBXCAEBGSA-N 1 1 375.314 3.079 10 0 GGAEMO C[N@H+]1CC[C@H](NC(=O)Cc2ccc(Br)cc2O)[C@H]1c1ccccc1 ZINC000491119290 566896150 /nfs/dbraw/zinc/89/61/50/566896150.db2.gz VPHGBKXBHVTKQR-QFBILLFUSA-N 1 1 389.293 3.259 10 0 GGAEMO C[C@@H](C(=O)Nc1cccc(I)c1)[N@@H+]1CC[C@@H](C(F)F)C1 ZINC000611180060 566896631 /nfs/dbraw/zinc/89/66/31/566896631.db2.gz QSVGJMYMYZKQRR-VHSXEESVSA-N 1 1 394.203 3.205 10 0 GGAEMO C[C@@H](C(=O)Nc1cccc(I)c1)[N@H+]1CC[C@@H](C(F)F)C1 ZINC000611180060 566896637 /nfs/dbraw/zinc/89/66/37/566896637.db2.gz QSVGJMYMYZKQRR-VHSXEESVSA-N 1 1 394.203 3.205 10 0 GGAEMO C[C@@H](CNC(=O)Cn1c[nH+]c2c1CCCC2)Oc1cccc(Br)c1 ZINC000543646458 566896924 /nfs/dbraw/zinc/89/69/24/566896924.db2.gz HXZYTUPWUYHOHX-ZDUSSCGKSA-N 1 1 392.297 3.108 10 0 GGAEMO CC[C@H](NC(=O)NC[C@@H]1CSCC[N@@H+]1Cc1ccccc1)C(F)(F)F ZINC000428992121 566897458 /nfs/dbraw/zinc/89/74/58/566897458.db2.gz ADDYEOSVUOUVQU-CABCVRRESA-N 1 1 375.460 3.244 10 0 GGAEMO CC[C@H](NC(=O)NC[C@@H]1CSCC[N@H+]1Cc1ccccc1)C(F)(F)F ZINC000428992121 566897463 /nfs/dbraw/zinc/89/74/63/566897463.db2.gz ADDYEOSVUOUVQU-CABCVRRESA-N 1 1 375.460 3.244 10 0 GGAEMO C[C@H]1CN(CC(F)(F)F)CC[N@@H+](CCC(=O)Nc2ccccc2Cl)C1 ZINC000451876043 566898565 /nfs/dbraw/zinc/89/85/65/566898565.db2.gz XIXGZXPOEXRBBD-CYBMUJFWSA-N 1 1 377.838 3.485 10 0 GGAEMO Cc1cc(NC(=O)[C@@H](C)N2CC[C@]3(CC[N@@H+](C)C3)C2)ccc1Br ZINC000429005704 566899370 /nfs/dbraw/zinc/89/93/70/566899370.db2.gz SFAYJCKHCSRJEI-KDOFPFPSSA-N 1 1 380.330 3.112 10 0 GGAEMO O[C@@H]([C@H]1CC[N@@H+](CCOc2cc(F)cc(Br)c2)C1)C(F)(F)F ZINC000451886872 566901162 /nfs/dbraw/zinc/90/11/62/566901162.db2.gz JFJMNKIJVPJRQQ-ZANVPECISA-N 1 1 386.183 3.212 10 0 GGAEMO O=C(CC[N@@H+]1CC[C@@H]([C@@H](O)C(F)(F)F)C1)Nc1ccccc1Br ZINC000451881511 566901297 /nfs/dbraw/zinc/90/12/97/566901297.db2.gz BKJHHQSPCLWIHH-QMTHXVAHSA-N 1 1 395.219 3.023 10 0 GGAEMO O=C(CC[N@@H+]1CC[C@H]([C@@H](O)C(F)(F)F)C1)Nc1ccccc1Br ZINC000451881506 566901481 /nfs/dbraw/zinc/90/14/81/566901481.db2.gz BKJHHQSPCLWIHH-IINYFYTJSA-N 1 1 395.219 3.023 10 0 GGAEMO O=C(CC[N@@H+]1CC[C@H]([C@@H](O)C(F)(F)F)C1)Nc1cccc(Br)c1 ZINC000451891948 566903008 /nfs/dbraw/zinc/90/30/08/566903008.db2.gz OXLKSBCLAIZGAR-IINYFYTJSA-N 1 1 395.219 3.023 10 0 GGAEMO CCOC(=O)C[C@H](O)C[N@H+]1CCC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000611238009 566903280 /nfs/dbraw/zinc/90/32/80/566903280.db2.gz WXYZFGDIJNXGEB-JSGCOSHPSA-N 1 1 376.280 3.151 10 0 GGAEMO O=C1C[C@@H]([N@H+]2CCC[C@H](CCF)C2)C(=O)N1c1ccc(Br)cc1 ZINC000656477137 566903504 /nfs/dbraw/zinc/90/35/04/566903504.db2.gz HCUSTNXHQKTBHM-IUODEOHRSA-N 1 1 383.261 3.153 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2cc(OC)c(Br)cn2)[C@@H](C)C1 ZINC000680368050 566903711 /nfs/dbraw/zinc/90/37/11/566903711.db2.gz FZOQNZJJLLKPRA-AAEUAGOBSA-N 1 1 385.306 3.047 10 0 GGAEMO C[C@H](NC(=O)C[N@H+]1CCC[C@]2(CCOC2)C1)c1ccc(Br)cc1 ZINC000451907581 566904426 /nfs/dbraw/zinc/90/44/26/566904426.db2.gz XIDZPEXOSMVDJI-KSSFIOAISA-N 1 1 381.314 3.129 10 0 GGAEMO CN(Cc1cc(Cl)cc(Cl)c1)C(=O)C[N@@H+]1CC[C@H]([C@@H](O)C(F)(F)F)C1 ZINC000451905641 566904721 /nfs/dbraw/zinc/90/47/21/566904721.db2.gz KSFKOOWQRRNPCA-XHDPSFHLSA-N 1 1 399.240 3.197 10 0 GGAEMO CN(Cc1cc(Cl)cc(Cl)c1)C(=O)C[N@H+]1CC[C@H]([C@@H](O)C(F)(F)F)C1 ZINC000451905641 566904727 /nfs/dbraw/zinc/90/47/27/566904727.db2.gz KSFKOOWQRRNPCA-XHDPSFHLSA-N 1 1 399.240 3.197 10 0 GGAEMO C[N@H+]1CC[C@]2(CCN(Cc3ccnc(-c4ccc(Br)cc4)n3)C2)C1 ZINC000429041396 566904963 /nfs/dbraw/zinc/90/49/63/566904963.db2.gz OZFDBHDJOLVJFR-IBGZPJMESA-N 1 1 387.325 3.434 10 0 GGAEMO O=C(Nc1ccc(Br)cn1)[C@@H]1CCC[N@@H+](CC[C@H]2CCCCO2)C1 ZINC000680374028 566905283 /nfs/dbraw/zinc/90/52/83/566905283.db2.gz AXYJAWVENYZHQG-GDBMZVCRSA-N 1 1 396.329 3.454 10 0 GGAEMO C[N@H+]1CC[C@]2(CCN(Cc3ccc(I)cc3Cl)C2)C1 ZINC000429036329 566905466 /nfs/dbraw/zinc/90/54/66/566905466.db2.gz PPJPKEZERSTFOK-HNNXBMFYSA-N 1 1 390.696 3.472 10 0 GGAEMO C[C@H](OC[C@H](O)C[N@H+]1CC[C@@H]([C@@H](O)C(F)(F)F)C1)c1ccc(Cl)cc1 ZINC000451911336 566906216 /nfs/dbraw/zinc/90/62/16/566906216.db2.gz POTRBKCFPOBCKO-KSZJFAHPSA-N 1 1 381.822 3.024 10 0 GGAEMO O[C@@H]([C@@H]1CC[N@@H+](CCc2nc(-c3cccc(Cl)c3)no2)C1)C(F)(F)F ZINC000451915568 566906366 /nfs/dbraw/zinc/90/63/66/566906366.db2.gz VRCPXQRXMJKKTG-RISCZKNCSA-N 1 1 375.778 3.178 10 0 GGAEMO C[C@H](OC[C@H](O)C[N@H+]1CC[C@@H]([C@H](O)C(F)(F)F)C1)c1ccc(Cl)cc1 ZINC000451911339 566906782 /nfs/dbraw/zinc/90/67/82/566906782.db2.gz POTRBKCFPOBCKO-ZCDTZLGTSA-N 1 1 381.822 3.024 10 0 GGAEMO C[C@H]1C[C@@H](N(C)S(=O)(=O)c2cccc(Br)c2Cl)CC[N@H+]1C ZINC000563676569 566907284 /nfs/dbraw/zinc/90/72/84/566907284.db2.gz IQXGRQFSQSFXBP-QWRGUYRKSA-N 1 1 395.750 3.206 10 0 GGAEMO O[C@H]([C@@H]1CC[N@@H+](CCc2nc(-c3ccc(Cl)cc3)no2)C1)C(F)(F)F ZINC000451919237 566907371 /nfs/dbraw/zinc/90/73/71/566907371.db2.gz ZGDVSCQGFSINIC-BXUZGUMPSA-N 1 1 375.778 3.178 10 0 GGAEMO C[C@H](NC(=O)[C@H](C)[N@@H+]1CC[C@@H]([C@@H](O)C(F)(F)F)C1)c1ccc(Cl)cc1 ZINC000451917648 566908185 /nfs/dbraw/zinc/90/81/85/566908185.db2.gz XPYWNCKJVBPLFJ-HTTKSJEASA-N 1 1 378.822 3.151 10 0 GGAEMO C[C@H](NC(=O)[C@H](C)[N@H+]1CC[C@@H]([C@@H](O)C(F)(F)F)C1)c1ccc(Cl)cc1 ZINC000451917648 566908189 /nfs/dbraw/zinc/90/81/89/566908189.db2.gz XPYWNCKJVBPLFJ-HTTKSJEASA-N 1 1 378.822 3.151 10 0 GGAEMO C[N@H+]1CC[C@H](NCc2nnc(-c3ccc(Br)cc3)[nH]2)[C@@H]2CCC[C@H]21 ZINC000563691015 566909240 /nfs/dbraw/zinc/90/92/40/566909240.db2.gz CNBQUYDNELYQAL-HRCADAONSA-N 1 1 390.329 3.197 10 0 GGAEMO C[N@@H+]1CC[C@H](NCc2nc(-c3ccc(Br)cc3)n[nH]2)[C@@H]2CCC[C@H]21 ZINC000563691015 566909248 /nfs/dbraw/zinc/90/92/48/566909248.db2.gz CNBQUYDNELYQAL-HRCADAONSA-N 1 1 390.329 3.197 10 0 GGAEMO C[N@H+]1CC[C@H](NCc2nc(-c3ccc(Br)cc3)n[nH]2)[C@@H]2CCC[C@H]21 ZINC000563691015 566909258 /nfs/dbraw/zinc/90/92/58/566909258.db2.gz CNBQUYDNELYQAL-HRCADAONSA-N 1 1 390.329 3.197 10 0 GGAEMO C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)N1CC[NH2+]C[C@](C)(F)C1 ZINC000582964193 566910326 /nfs/dbraw/zinc/91/03/26/566910326.db2.gz UXDPXNYOEYWEFA-BMIGLBTASA-N 1 1 393.684 3.030 10 0 GGAEMO Cc1cc(C[NH2+][C@@H]2CCCOc3ccc(I)cc32)ncn1 ZINC000611337243 566910681 /nfs/dbraw/zinc/91/06/81/566910681.db2.gz HOHZDSGJGCKZCL-OAHLLOKOSA-N 1 1 395.244 3.393 10 0 GGAEMO Cc1cccc(NC(=O)C[NH2+][C@@H](CCO)c2ccccc2Br)c1 ZINC000543808163 566912489 /nfs/dbraw/zinc/91/24/89/566912489.db2.gz ZEGHPXCSEPCKPV-KRWDZBQOSA-N 1 1 377.282 3.409 10 0 GGAEMO OC[C@H]([NH2+]C[C@H](O)COc1c(Cl)cccc1Cl)c1c(F)cccc1F ZINC000543813850 566913192 /nfs/dbraw/zinc/91/31/92/566913192.db2.gz WWGTZCBDXINTMQ-BONVTDFDSA-N 1 1 392.229 3.335 10 0 GGAEMO O=C(c1oc2ccccc2c1Br)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000632791219 566913840 /nfs/dbraw/zinc/91/38/40/566913840.db2.gz GHSRWOMJSLISTH-CHWSQXEVSA-N 1 1 381.245 3.454 10 0 GGAEMO C[N@H+]1CCCC(C)(C)[C@@H]1CNC(=O)Cc1csc(CCC(F)(F)F)n1 ZINC000632797905 566914238 /nfs/dbraw/zinc/91/42/38/566914238.db2.gz OXPPBAXZLLLRSC-ZDUSSCGKSA-N 1 1 377.476 3.417 10 0 GGAEMO CC[C@@H]1CC[C@H](C)[N@@H+](CC(=O)NCC(=O)Nc2ccccc2Br)C1 ZINC000451960018 566915334 /nfs/dbraw/zinc/91/53/34/566915334.db2.gz ZFPQDEFCOBYUJQ-UONOGXRCSA-N 1 1 396.329 3.014 10 0 GGAEMO O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1c(F)cncc1Br ZINC000632813158 566915767 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10 0 GGAEMO C[C@H](Cn1cc(Br)ccc1=O)NCC(C)(C)[N@@H+]1C[C@H](C)C[C@H](C)C1 ZINC000565096307 567038505 /nfs/dbraw/zinc/03/85/05/567038505.db2.gz NBBORJYIFPXHIS-OWCLPIDISA-N 1 1 398.389 3.345 10 0 GGAEMO C[C@H](Cn1cc(Br)ccc1=O)[NH2+]CC(C)(C)N1C[C@H](C)C[C@H](C)C1 ZINC000565096307 567038514 /nfs/dbraw/zinc/03/85/14/567038514.db2.gz NBBORJYIFPXHIS-OWCLPIDISA-N 1 1 398.389 3.345 10 0 GGAEMO C[N@H+](Cc1ccccc1)C[C@H](N)c1nc(-c2ccc(Br)o2)no1 ZINC000634555094 567038814 /nfs/dbraw/zinc/03/88/14/567038814.db2.gz ZZJJROVSNQVGQQ-LBPRGKRZSA-N 1 1 377.242 3.224 10 0 GGAEMO CCOc1c(Br)cc(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)cc1OC ZINC000521082193 567040602 /nfs/dbraw/zinc/04/06/02/567040602.db2.gz PVWUJVKWNFLIHF-AWEZNQCLSA-N 1 1 397.313 3.165 10 0 GGAEMO COc1cccc([C@H](C[NH2+]Cc2c(F)cncc2Br)N(C)C)c1 ZINC000657285402 567044801 /nfs/dbraw/zinc/04/48/01/567044801.db2.gz CADBXDLETIXBON-KRWDZBQOSA-N 1 1 382.277 3.384 10 0 GGAEMO CN([C@@H]1CC[N@@H+](C2CC2)C1)S(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000521171303 567045058 /nfs/dbraw/zinc/04/50/58/567045058.db2.gz HJUDZBHWYMGCJO-OAHLLOKOSA-N 1 1 397.953 3.321 10 0 GGAEMO CN([C@@H]1CC[N@H+](C2CC2)C1)S(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000521171303 567045067 /nfs/dbraw/zinc/04/50/67/567045067.db2.gz HJUDZBHWYMGCJO-OAHLLOKOSA-N 1 1 397.953 3.321 10 0 GGAEMO Cc1c(Br)cncc1C(=O)N[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000613543280 567045057 /nfs/dbraw/zinc/04/50/57/567045057.db2.gz AUTXFPZYBYURQF-SCLBCKFNSA-N 1 1 388.309 3.403 10 0 GGAEMO Fc1cncc(Br)c1CNCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000657292889 567045291 /nfs/dbraw/zinc/04/52/91/567045291.db2.gz FKPXBCIGQNDOBN-UHFFFAOYSA-N 1 1 394.288 3.105 10 0 GGAEMO Cc1[nH+]cc2n1CC[C@H](C(=O)N1CCc3cc(Br)cc(C)c3C1)C2 ZINC000584462660 567045418 /nfs/dbraw/zinc/04/54/18/567045418.db2.gz VTBLKGLSVAUNNI-HNNXBMFYSA-N 1 1 388.309 3.410 10 0 GGAEMO Cc1[nH+]cc2n1CC[C@@H](C(=O)N1CCc3cc(Br)cc(C)c3C1)C2 ZINC000584462661 567045506 /nfs/dbraw/zinc/04/55/06/567045506.db2.gz VTBLKGLSVAUNNI-OAHLLOKOSA-N 1 1 388.309 3.410 10 0 GGAEMO COc1ccc(CCC(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)c(Br)c1 ZINC000613579488 567045822 /nfs/dbraw/zinc/04/58/22/567045822.db2.gz OTJLXAHRWBMNEC-OAHLLOKOSA-N 1 1 383.330 3.379 10 0 GGAEMO CC1(C)C[NH+](CC(=O)N2CCC[C@H]2c2ccc(I)cc2)C1 ZINC000565192333 567046113 /nfs/dbraw/zinc/04/61/13/567046113.db2.gz ZJLXTIDUWXUALL-HNNXBMFYSA-N 1 1 398.288 3.297 10 0 GGAEMO COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000682458440 567045988 /nfs/dbraw/zinc/04/59/88/567045988.db2.gz XGBLWTUOMUCOAL-WFASDCNBSA-N 1 1 396.329 3.302 10 0 GGAEMO COc1ccc(CCC(=O)N[C@H]2CCC[N@H+](C(C)C)C2)c(Br)c1 ZINC000613579487 567046406 /nfs/dbraw/zinc/04/64/06/567046406.db2.gz OTJLXAHRWBMNEC-HNNXBMFYSA-N 1 1 383.330 3.379 10 0 GGAEMO CC[N@@H+](CCNC(=O)c1cc(C)n(-c2ccc(Br)cc2)n1)C1CC1 ZINC000431020125 567046739 /nfs/dbraw/zinc/04/67/39/567046739.db2.gz WSAIFWJKPZZJRL-UHFFFAOYSA-N 1 1 391.313 3.157 10 0 GGAEMO CC[N@@H+](CCc1nnnn1-c1ccccc1)Cc1cccc(Br)c1 ZINC000521221840 567048641 /nfs/dbraw/zinc/04/86/41/567048641.db2.gz ZNURTQKKTWDQRQ-UHFFFAOYSA-N 1 1 386.297 3.489 10 0 GGAEMO Cc1cc(C(=O)NCC[N@H+](C)C(C)C)nn1-c1ccc(Br)cc1 ZINC000431035126 567048735 /nfs/dbraw/zinc/04/87/35/567048735.db2.gz CDZIROGJFMAYAO-UHFFFAOYSA-N 1 1 379.302 3.013 10 0 GGAEMO CC(=O)Nc1cccc(OCC[NH2+]Cc2c(F)cncc2Br)c1 ZINC000657346697 567049713 /nfs/dbraw/zinc/04/97/13/567049713.db2.gz MXRJLYHIGKOLHA-UHFFFAOYSA-N 1 1 382.233 3.110 10 0 GGAEMO COc1ccc(Br)c(C[NH2+]Cc2c(C(F)(F)F)cnn2C)c1 ZINC000657333867 567049945 /nfs/dbraw/zinc/04/99/45/567049945.db2.gz CFTTVXFUNQGGTJ-UHFFFAOYSA-N 1 1 378.192 3.500 10 0 GGAEMO CC[C@@H](c1ccc(Br)cc1)[N@H+]1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000472775444 567051016 /nfs/dbraw/zinc/05/10/16/567051016.db2.gz UUAXJJKZNYPUJG-WMZOPIPTSA-N 1 1 395.341 3.471 10 0 GGAEMO Cc1ccc(Br)cc1NC(=O)CC[NH2+]Cc1cn(C2CCC2)nn1 ZINC000657360406 567051126 /nfs/dbraw/zinc/05/11/26/567051126.db2.gz GMQYRRZRNKKBQK-UHFFFAOYSA-N 1 1 392.301 3.192 10 0 GGAEMO Cn1ncc(C(F)(F)F)c1CNCC1([NH+]2CCSCC2)CCCCC1 ZINC000657369493 567051532 /nfs/dbraw/zinc/05/15/32/567051532.db2.gz HNXXYBYLMHDYDZ-UHFFFAOYSA-N 1 1 376.492 3.280 10 0 GGAEMO CN1CC[C@H]([NH2+]CCCNC(=O)c2cccc(Br)c2)[C@H]2CCC[C@H]21 ZINC000565263348 567051821 /nfs/dbraw/zinc/05/18/21/567051821.db2.gz WFPHDVLQFMELLJ-FGTMMUONSA-N 1 1 394.357 3.031 10 0 GGAEMO O[C@@H](C[NH2+]Cc1nccn1CC(F)(F)F)COc1cc(Cl)cc(Cl)c1 ZINC000634702682 567054101 /nfs/dbraw/zinc/05/41/01/567054101.db2.gz KCIRGQDQCCDCGV-LBPRGKRZSA-N 1 1 398.212 3.282 10 0 GGAEMO Cn1nc(C(F)(F)F)cc1C[NH2+][C@H](CO)c1cccc(Br)c1 ZINC000657398239 567054372 /nfs/dbraw/zinc/05/43/72/567054372.db2.gz AHZZEFNVRPDMMN-GFCCVEGCSA-N 1 1 378.192 3.025 10 0 GGAEMO C[S@](=O)c1cccc(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)c1 ZINC000613705007 567056754 /nfs/dbraw/zinc/05/67/54/567056754.db2.gz CLWRFCZPYRGABK-BZQUYTCOSA-N 1 1 376.547 3.128 10 0 GGAEMO C[N@H+]1CCC[C@H](CNC(=O)c2cccc([S@@](C)=O)c2)[C@H]1c1cccs1 ZINC000613711006 567057222 /nfs/dbraw/zinc/05/72/22/567057222.db2.gz XXVWPTOCNLNVQK-HYGPGOAJSA-N 1 1 376.547 3.298 10 0 GGAEMO CN([C@@H]1CC[N@@H+](C2CC2)C1)S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000521376704 567057690 /nfs/dbraw/zinc/05/76/90/567057690.db2.gz IMBGQQWAUPIAQC-GFCCVEGCSA-N 1 1 382.835 3.216 10 0 GGAEMO CN([C@@H]1CC[N@H+](C2CC2)C1)S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000521376704 567057693 /nfs/dbraw/zinc/05/76/93/567057693.db2.gz IMBGQQWAUPIAQC-GFCCVEGCSA-N 1 1 382.835 3.216 10 0 GGAEMO Cn1nc(C(F)(F)F)cc1C[NH2+][C@@](C)(CO)c1ccc(Br)cc1 ZINC000657464070 567058337 /nfs/dbraw/zinc/05/83/37/567058337.db2.gz KEDFNECVESDTSG-AWEZNQCLSA-N 1 1 392.219 3.199 10 0 GGAEMO O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)N[C@@H](CO)c1ccsc1 ZINC000472962482 567058477 /nfs/dbraw/zinc/05/84/77/567058477.db2.gz WHYMJVXYZWHUIT-PBHICJAKSA-N 1 1 379.551 3.054 10 0 GGAEMO Brc1cccc(N2CC[C@H]([NH2+]Cc3ccnn3-c3ccncc3)C2)c1 ZINC000657451206 567059171 /nfs/dbraw/zinc/05/91/71/567059171.db2.gz KBXHUQCFAIJKFL-INIZCTEOSA-N 1 1 398.308 3.398 10 0 GGAEMO Fc1cncc(Br)c1C[NH2+]Cc1cccc(N2CCOCC2)c1 ZINC000657473492 567059942 /nfs/dbraw/zinc/05/99/42/567059942.db2.gz KVORZLRHCQIBHH-UHFFFAOYSA-N 1 1 380.261 3.110 10 0 GGAEMO Cc1cc(C(=O)N2CC[NH+](C(C)C)CC2)nn1-c1ccc(Br)cc1 ZINC000431159822 567059967 /nfs/dbraw/zinc/05/99/67/567059967.db2.gz IYOFRDQKHHCKMQ-UHFFFAOYSA-N 1 1 391.313 3.109 10 0 GGAEMO COC[C@]1(C[NH2+]Cc2c(F)cncc2Br)OCCc2ccccc21 ZINC000657468421 567060567 /nfs/dbraw/zinc/06/05/67/567060567.db2.gz OKBDSTSZQPSVIX-SFHVURJKSA-N 1 1 395.272 3.187 10 0 GGAEMO FC(F)(F)C1(C[NH2+]Cc2cn(-c3ccccc3Br)nn2)CC1 ZINC000584689962 567061973 /nfs/dbraw/zinc/06/19/73/567061973.db2.gz ODKRAXCZJGAODC-UHFFFAOYSA-N 1 1 375.192 3.462 10 0 GGAEMO CCS(=O)(=O)c1cc(Cl)cc(C[NH2+]Cc2c(C(F)(F)F)cnn2C)c1 ZINC000657491517 567062787 /nfs/dbraw/zinc/06/27/87/567062787.db2.gz VLNOIZMNGSPDDV-UHFFFAOYSA-N 1 1 395.834 3.176 10 0 GGAEMO C[N@H+]1C[C@@H](CNCc2c(F)cncc2Br)[C@H](c2ccccc2)C1 ZINC000657500710 567063151 /nfs/dbraw/zinc/06/31/51/567063151.db2.gz QZEWPDRYTHECRK-ZBFHGGJFSA-N 1 1 378.289 3.418 10 0 GGAEMO CCOC(=O)c1nn(C)cc1C[NH2+]Cc1c(C)cc(Br)cc1C ZINC000473126717 567063205 /nfs/dbraw/zinc/06/32/05/567063205.db2.gz XWXDQDARYJFAJZ-UHFFFAOYSA-N 1 1 380.286 3.266 10 0 GGAEMO CCN(CC)C(=O)C1CC[NH+](Cc2ccc(OC)c(O)c2Br)CC1 ZINC000545560146 567063513 /nfs/dbraw/zinc/06/35/13/567063513.db2.gz AMAMUEBGRFXLHH-UHFFFAOYSA-N 1 1 399.329 3.244 10 0 GGAEMO CC(C)[N@@H+](C)C[C@H](C)NC(=O)c1ncc(Br)cc1Br ZINC000565394664 567063910 /nfs/dbraw/zinc/06/39/10/567063910.db2.gz LRULLCLLURISQX-VIFPVBQESA-N 1 1 393.123 3.065 10 0 GGAEMO C[C@H]1CC[N@@H+](CC(=O)Nc2ccc(CCn3cc(Br)cn3)cc2)C1 ZINC000584730999 567064627 /nfs/dbraw/zinc/06/46/27/567064627.db2.gz VUTZXSJFKGFEON-AWEZNQCLSA-N 1 1 391.313 3.169 10 0 GGAEMO CC[N@@H+](C)C[C@H]1CCN(C(=O)N[C@@H]2C[C@H]2c2ccccc2Br)C1 ZINC000431188806 567064823 /nfs/dbraw/zinc/06/48/23/567064823.db2.gz CBRUBFRRAIGBEF-UKPHBRMFSA-N 1 1 380.330 3.288 10 0 GGAEMO C[C@@H]([NH2+][C@@H](CO)c1ccsc1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000473159715 567065048 /nfs/dbraw/zinc/06/50/48/567065048.db2.gz DBZORNIBJDPLKN-DOMZBBRYSA-N 1 1 375.519 3.028 10 0 GGAEMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@@H]2C[C@H]2c2ccccc2Br)C1 ZINC000431188805 567065136 /nfs/dbraw/zinc/06/51/36/567065136.db2.gz CBRUBFRRAIGBEF-JLJPHGGASA-N 1 1 380.330 3.288 10 0 GGAEMO O=C(C[NH2+][C@H](CO)c1ccsc1)Nc1nc(-c2ccc(F)cc2)cs1 ZINC000473167026 567065179 /nfs/dbraw/zinc/06/51/79/567065179.db2.gz RJFVVDDRFRXASA-CQSZACIVSA-N 1 1 377.466 3.272 10 0 GGAEMO CN(C(=O)N[C@@H]1C[C@H]1c1ccccc1Br)[C@H]1CC[N@H+](C2CC2)C1 ZINC000431190910 567065551 /nfs/dbraw/zinc/06/55/51/567065551.db2.gz CGCLNXYJVFQFSB-JLJPHGGASA-N 1 1 378.314 3.183 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@H]1CNCc1ccc(Br)cc1N1CCOCC1 ZINC000657527640 567065648 /nfs/dbraw/zinc/06/56/48/567065648.db2.gz WYQNAEMLVDBUJO-KRWDZBQOSA-N 1 1 396.373 3.248 10 0 GGAEMO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@H](CO)c2ccsc2)c(Br)c1 ZINC000473169398 567065677 /nfs/dbraw/zinc/06/56/77/567065677.db2.gz JKFIAENYQVHNDP-IAQYHMDHSA-N 1 1 383.311 3.469 10 0 GGAEMO Cn1ncc(C2CC2)c1C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000613841309 567065880 /nfs/dbraw/zinc/06/58/80/567065880.db2.gz KUAKDTFWYLQJGD-UHFFFAOYSA-N 1 1 377.286 3.374 10 0 GGAEMO CC(C)[N@H+]1CCCN(C(=O)N[C@@H]2C[C@H]2c2ccccc2Br)CC1 ZINC000431190338 567065784 /nfs/dbraw/zinc/06/57/84/567065784.db2.gz GTZIURZZHHRGAB-DOTOQJQBSA-N 1 1 380.330 3.431 10 0 GGAEMO COc1cc(CCC(=O)Nc2ccc(C[NH+](C)C)c(Br)c2)on1 ZINC000613841427 567066041 /nfs/dbraw/zinc/06/60/41/567066041.db2.gz ODZBCEMZCDDJCM-UHFFFAOYSA-N 1 1 382.258 3.079 10 0 GGAEMO O=S(=O)(CC[NH2+][C@@H](CO)c1ccsc1)c1cc(Cl)ccc1Cl ZINC000473175615 567066958 /nfs/dbraw/zinc/06/69/58/567066958.db2.gz TYEMYDZRNFPGOF-ZDUSSCGKSA-N 1 1 380.318 3.152 10 0 GGAEMO C[C@@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1ccc(F)c(I)c1 ZINC000453248051 567067684 /nfs/dbraw/zinc/06/76/84/567067684.db2.gz ISDJSWCRGPRECL-KOLCDFICSA-N 1 1 385.224 3.362 10 0 GGAEMO C[C@H]([NH2+][C@@H](CO)c1ccsc1)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000473178715 567067691 /nfs/dbraw/zinc/06/76/91/567067691.db2.gz ZNSJMHDUSFTCHK-LRDDRELGSA-N 1 1 397.338 3.181 10 0 GGAEMO O=C(C[NH2+][C@@H](CO)c1ccsc1)Nc1c(F)cc(F)cc1Br ZINC000473176368 567067894 /nfs/dbraw/zinc/06/78/94/567067894.db2.gz RIROCXROEZHKLX-LBPRGKRZSA-N 1 1 391.237 3.051 10 0 GGAEMO OCCC[N@@H+]1CCC[C@H]1CN[C@H]1CCCOc2ccc(Br)cc21 ZINC000453266982 567069742 /nfs/dbraw/zinc/06/97/42/567069742.db2.gz OVHCDUNOUIZAEM-RDJZCZTQSA-N 1 1 383.330 3.099 10 0 GGAEMO OCCC[N@H+]1CCC[C@H]1CN[C@H]1CCCOc2ccc(Br)cc21 ZINC000453266982 567069746 /nfs/dbraw/zinc/06/97/46/567069746.db2.gz OVHCDUNOUIZAEM-RDJZCZTQSA-N 1 1 383.330 3.099 10 0 GGAEMO C[N@H+]1CCCC[C@@H]1CCC(=O)N[C@H]1CCN(c2ccc(Br)cc2)C1 ZINC000496111601 567069988 /nfs/dbraw/zinc/06/99/88/567069988.db2.gz NOCMAUFERPYBKX-DLBZAZTESA-N 1 1 394.357 3.409 10 0 GGAEMO OCCC[N@@H+]1CCC[C@@H]1CN[C@H]1CCCOc2ccc(Br)cc21 ZINC000453266986 567069985 /nfs/dbraw/zinc/06/99/85/567069985.db2.gz OVHCDUNOUIZAEM-WBVHZDCISA-N 1 1 383.330 3.099 10 0 GGAEMO OCCC[N@H+]1CCC[C@@H]1CN[C@H]1CCCOc2ccc(Br)cc21 ZINC000453266986 567069989 /nfs/dbraw/zinc/06/99/89/567069989.db2.gz OVHCDUNOUIZAEM-WBVHZDCISA-N 1 1 383.330 3.099 10 0 GGAEMO Cc1ccc(S(=O)(=O)NCC[N@H+](C)C2CCCCC2)c(Br)c1 ZINC000521638400 567070405 /nfs/dbraw/zinc/07/04/05/567070405.db2.gz UILZCXQDILYOAU-UHFFFAOYSA-N 1 1 389.359 3.300 10 0 GGAEMO Oc1cccc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1Br ZINC000657597300 567074734 /nfs/dbraw/zinc/07/47/34/567074734.db2.gz SPAYTBYUXZBRAE-KRWDZBQOSA-N 1 1 391.309 3.011 10 0 GGAEMO C[C@H]1CCC[C@H](C)[NH+]1CCNS(=O)(=O)c1sccc1Br ZINC000521688168 567074864 /nfs/dbraw/zinc/07/48/64/567074864.db2.gz BUJYVYWFSBECQH-QWRGUYRKSA-N 1 1 381.361 3.052 10 0 GGAEMO Cc1ccc(C(=O)NC[C@H](C(C)C)[NH+]2CCOCC2)c(C)c1Br ZINC000682856234 567075773 /nfs/dbraw/zinc/07/57/73/567075773.db2.gz DYQNMERQSBQHIG-MRXNPFEDSA-N 1 1 383.330 3.153 10 0 GGAEMO COc1ccc(C[N@@H+]2CC[C@H](c3nc(C4CC4)no3)C2)c(Br)c1O ZINC000496446629 567075899 /nfs/dbraw/zinc/07/58/99/567075899.db2.gz DLLNNZZWBHUDJG-LBPRGKRZSA-N 1 1 394.269 3.413 10 0 GGAEMO COc1ccc(C[N@H+]2CC[C@H](c3nc(C4CC4)no3)C2)c(Br)c1O ZINC000496446629 567075907 /nfs/dbraw/zinc/07/59/07/567075907.db2.gz DLLNNZZWBHUDJG-LBPRGKRZSA-N 1 1 394.269 3.413 10 0 GGAEMO Cc1nc(C[NH+]2CCC(C(=O)N3CC[C@H](C(F)(F)F)[C@@H]3C)CC2)cs1 ZINC000473389589 567076466 /nfs/dbraw/zinc/07/64/66/567076466.db2.gz PFUADAWQGRIMQE-NHYWBVRUSA-N 1 1 375.460 3.463 10 0 GGAEMO C[C@@H]1CC[C@H]([NH2+]Cc2cccc(Br)c2OC(F)F)CS1(=O)=O ZINC000657639925 567078426 /nfs/dbraw/zinc/07/84/26/567078426.db2.gz WGZNQAQFIYEJCY-KOLCDFICSA-N 1 1 398.269 3.106 10 0 GGAEMO Cc1cc(Br)c(C[NH2+][C@H]2CC[C@@H](C)S(=O)(=O)C2)cc1Cl ZINC000657640027 567078582 /nfs/dbraw/zinc/07/85/82/567078582.db2.gz UUXSLEPIUGHHRL-PWSUYJOCSA-N 1 1 380.735 3.466 10 0 GGAEMO CN1CC[C@H]([NH2+]C[C@H](CO)Cc2cc(Br)ccc2F)[C@H]2CCC[C@@H]21 ZINC000453367419 567080565 /nfs/dbraw/zinc/08/05/65/567080565.db2.gz MMFZCPKHVCFETQ-OLQIXAPSSA-N 1 1 399.348 3.202 10 0 GGAEMO Cc1ccc(C(=O)N(C)CC[N@@H+](C)C2CCN(C)CC2)c(C)c1Br ZINC000682898314 567081469 /nfs/dbraw/zinc/08/14/69/567081469.db2.gz AABUTOKTUDEJIR-UHFFFAOYSA-N 1 1 396.373 3.164 10 0 GGAEMO Cc1ccc(C(=O)N(C)CCN(C)C2CC[NH+](C)CC2)c(C)c1Br ZINC000682898314 567081475 /nfs/dbraw/zinc/08/14/75/567081475.db2.gz AABUTOKTUDEJIR-UHFFFAOYSA-N 1 1 396.373 3.164 10 0 GGAEMO O=C(N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1)C1(Cc2ccccc2Br)CC1 ZINC000614088266 567082317 /nfs/dbraw/zinc/08/23/17/567082317.db2.gz ARLFBCRHTGCQMD-IAGOWNOFSA-N 1 1 395.316 3.417 10 0 GGAEMO Cc1ccc(C(=O)N2CC[NH+](CCOC(C)C)CC2)c(C)c1Br ZINC000682912985 567082488 /nfs/dbraw/zinc/08/24/88/567082488.db2.gz PRFSQOMIFDQPMZ-UHFFFAOYSA-N 1 1 383.330 3.249 10 0 GGAEMO Cc1ccc(C(=O)NCCCC[N@H+]2CCC[C@H]2CO)c(C)c1Br ZINC000682922849 567082691 /nfs/dbraw/zinc/08/26/91/567082691.db2.gz UPSWZKRXCSERGS-HNNXBMFYSA-N 1 1 383.330 3.033 10 0 GGAEMO O=C(c1cc(Cl)c(Br)cc1F)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614089080 567082618 /nfs/dbraw/zinc/08/26/18/567082618.db2.gz HASRTEVYOJFULQ-KBPBESRZSA-N 1 1 393.659 3.500 10 0 GGAEMO O=C(c1nc2ccccc2cc1Br)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614088246 567082776 /nfs/dbraw/zinc/08/27/76/567082776.db2.gz AMMCWOBNKGTCNM-GOEBONIOSA-N 1 1 392.272 3.256 10 0 GGAEMO CS(=O)(=O)c1cccc(Cl)c1C[NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1 ZINC000657656469 567082833 /nfs/dbraw/zinc/08/28/33/567082833.db2.gz PODDAHDPJWKEID-HOTGVXAUSA-N 1 1 379.909 3.406 10 0 GGAEMO O=C(c1cc2c(Br)cccc2cn1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614089304 567083039 /nfs/dbraw/zinc/08/30/39/567083039.db2.gz INHGGPUBVMUDNA-WBVHZDCISA-N 1 1 392.272 3.256 10 0 GGAEMO CC1=CC[N@@H+](CCNC(=O)c2cc(=O)[nH]c3ccc(Br)cc32)CC1 ZINC000545869351 567083222 /nfs/dbraw/zinc/08/32/22/567083222.db2.gz HWKGXNMQOWFXPN-UHFFFAOYSA-N 1 1 390.281 3.085 10 0 GGAEMO O=C(Cc1cc(Cl)ccc1Br)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614096209 567083800 /nfs/dbraw/zinc/08/38/00/567083800.db2.gz XMNIYRWLLJDQNX-GJZGRUSLSA-N 1 1 389.696 3.290 10 0 GGAEMO COc1cc(Br)ccc1CCC(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614092030 567084030 /nfs/dbraw/zinc/08/40/30/567084030.db2.gz HNDBPNTXAVPUTF-HZPDHXFCSA-N 1 1 399.304 3.035 10 0 GGAEMO COc1cc(C)c(Br)cc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614099520 567084121 /nfs/dbraw/zinc/08/41/21/567084121.db2.gz WEGZDHIGJJNLKA-HUUCEWRRSA-N 1 1 385.277 3.024 10 0 GGAEMO O=C(c1cc(F)c(Br)c(Cl)c1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614097686 567084283 /nfs/dbraw/zinc/08/42/83/567084283.db2.gz JZULYTUBLUQMKD-CHWSQXEVSA-N 1 1 393.659 3.500 10 0 GGAEMO C[C@H](Cc1ccc(Br)cc1)C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614095348 567084331 /nfs/dbraw/zinc/08/43/31/567084331.db2.gz XOIANIIAJGKQGF-KBRIMQKVSA-N 1 1 383.305 3.272 10 0 GGAEMO CSc1ccc(Cl)c(NC(=O)C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC000657683458 567084408 /nfs/dbraw/zinc/08/44/08/567084408.db2.gz LKFBEJGYSGUONJ-YHWZYXNKSA-N 1 1 381.929 3.132 10 0 GGAEMO O=C(c1ccc(Br)c(Cl)c1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614096480 567084459 /nfs/dbraw/zinc/08/44/59/567084459.db2.gz YUFREJQKBADEGP-ZIAGYGMSSA-N 1 1 375.669 3.361 10 0 GGAEMO Cn1cc(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@H](F)C2)c(-c2ccc(Cl)s2)n1 ZINC000614092816 567084580 /nfs/dbraw/zinc/08/45/80/567084580.db2.gz MELDXWQHSBFIDR-CHWSQXEVSA-N 1 1 382.892 3.060 10 0 GGAEMO O=C(CCCc1ccccc1Br)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614091515 567084617 /nfs/dbraw/zinc/08/46/17/567084617.db2.gz APJAGBNUDAUUOP-DLBZAZTESA-N 1 1 383.305 3.417 10 0 GGAEMO C[C@H](Cc1ccc(Br)cc1)C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614095350 567084832 /nfs/dbraw/zinc/08/48/32/567084832.db2.gz XOIANIIAJGKQGF-XOKHGSTOSA-N 1 1 383.305 3.272 10 0 GGAEMO Cc1ccc(C(=O)N(C)CC(C)(C)C[NH+]2CCOCC2)c(C)c1Br ZINC000682923782 567084811 /nfs/dbraw/zinc/08/48/11/567084811.db2.gz CWSCJBKKESBSCP-UHFFFAOYSA-N 1 1 397.357 3.496 10 0 GGAEMO O=C(CCc1cc(Br)cs1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614092451 567085108 /nfs/dbraw/zinc/08/51/08/567085108.db2.gz FUYQDERNLIFTLL-KBPBESRZSA-N 1 1 375.307 3.088 10 0 GGAEMO O=C(CCCc1ccc(Br)s1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614103792 567085800 /nfs/dbraw/zinc/08/58/00/567085800.db2.gz DEMBAIMOPUHVPX-KGLIPLIRSA-N 1 1 389.334 3.478 10 0 GGAEMO O=C(Cc1c(Cl)cccc1Br)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614102065 567085819 /nfs/dbraw/zinc/08/58/19/567085819.db2.gz FRPLDHUROROTBE-GJZGRUSLSA-N 1 1 389.696 3.290 10 0 GGAEMO C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614102141 567085951 /nfs/dbraw/zinc/08/59/51/567085951.db2.gz NHLGONOTSSJKOM-XZJROXQQSA-N 1 1 375.271 3.405 10 0 GGAEMO C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614104669 567086012 /nfs/dbraw/zinc/08/60/12/567086012.db2.gz HZYWRUSVAPYGGE-CQDKDKBSSA-N 1 1 375.271 3.405 10 0 GGAEMO Cc1ccc(C(=O)NC(C)(C)CCN2CC[NH+](C)CC2)c(C)c1Br ZINC000682934825 567086067 /nfs/dbraw/zinc/08/60/67/567086067.db2.gz PBTKJXZXKPSTOL-UHFFFAOYSA-N 1 1 396.373 3.212 10 0 GGAEMO CC(C)[C@@H](CNC(=O)C[C@@H](C)c1ccc(Br)cc1)[NH+]1CCOCC1 ZINC000431512583 567086077 /nfs/dbraw/zinc/08/60/77/567086077.db2.gz GZCJNTCKQMJJOC-CRAIPNDOSA-N 1 1 397.357 3.416 10 0 GGAEMO CSc1cc(Br)ccc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614103264 567086232 /nfs/dbraw/zinc/08/62/32/567086232.db2.gz LKGXOLDYJVRUJC-UONOGXRCSA-N 1 1 387.318 3.429 10 0 GGAEMO CC(C)[C@H](CNC(=O)C[C@H](C)c1ccc(Br)cc1)[NH+]1CCOCC1 ZINC000431512586 567086497 /nfs/dbraw/zinc/08/64/97/567086497.db2.gz GZCJNTCKQMJJOC-YJBOKZPZSA-N 1 1 397.357 3.416 10 0 GGAEMO O=C(CCc1ccc(Br)cc1F)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614104101 567086545 /nfs/dbraw/zinc/08/65/45/567086545.db2.gz USETYMADLAFZCJ-CVEARBPZSA-N 1 1 387.268 3.166 10 0 GGAEMO CC[C@@H]([NH2+][C@@H](C)c1ccc(Br)cc1Br)C(=O)NC ZINC000453420507 567086680 /nfs/dbraw/zinc/08/66/80/567086680.db2.gz WJJNWJCQZGGDMP-QPUJVOFHSA-N 1 1 378.108 3.387 10 0 GGAEMO O=C(CCCc1ccc(Br)s1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614103793 567086729 /nfs/dbraw/zinc/08/67/29/567086729.db2.gz DEMBAIMOPUHVPX-UONOGXRCSA-N 1 1 389.334 3.478 10 0 GGAEMO Cc1ccc(O[C@H](C)C(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)c(Br)c1 ZINC000614105067 567086783 /nfs/dbraw/zinc/08/67/83/567086783.db2.gz ZQEZWUFQQBAOKS-KBMXLJTQSA-N 1 1 399.304 3.170 10 0 GGAEMO O=C(CCOc1ccc(Cl)c(Cl)c1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614105039 567086796 /nfs/dbraw/zinc/08/67/96/567086796.db2.gz ZGPBQFCVPSOLRC-JKSUJKDBSA-N 1 1 375.271 3.407 10 0 GGAEMO O=C(CSc1cccc(C(F)(F)F)c1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614104047 567086824 /nfs/dbraw/zinc/08/68/24/567086824.db2.gz FBYYANHBIDKFTF-CABCVRRESA-N 1 1 376.419 3.442 10 0 GGAEMO C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614101923 567086835 /nfs/dbraw/zinc/08/68/35/567086835.db2.gz NHLGONOTSSJKOM-UVBJJODRSA-N 1 1 375.271 3.405 10 0 GGAEMO COc1ccc(CCC(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)c(Br)c1 ZINC000614105170 567086871 /nfs/dbraw/zinc/08/68/71/567086871.db2.gz JPDSBLWXSVIZET-IRXDYDNUSA-N 1 1 399.304 3.035 10 0 GGAEMO O=C(CCc1ccc(Br)cc1F)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614104102 567086939 /nfs/dbraw/zinc/08/69/39/567086939.db2.gz USETYMADLAFZCJ-HOTGVXAUSA-N 1 1 387.268 3.166 10 0 GGAEMO OC[C@]1(NCc2ccc(Br)o2)CCC[N@H+](Cc2ccccc2)C1 ZINC000682943370 567087506 /nfs/dbraw/zinc/08/75/06/567087506.db2.gz UWMCBXAFQGLPTH-SFHVURJKSA-N 1 1 379.298 3.159 10 0 GGAEMO OC[C@]1(NCc2ccc(Br)o2)CCC[N@@H+](Cc2ccccc2)C1 ZINC000682943370 567087508 /nfs/dbraw/zinc/08/75/08/567087508.db2.gz UWMCBXAFQGLPTH-SFHVURJKSA-N 1 1 379.298 3.159 10 0 GGAEMO C[N@@H+]1CCO[C@@H](CSCC(=O)N[C@@H](c2cccs2)c2ccccc2)C1 ZINC000565657143 567088098 /nfs/dbraw/zinc/08/80/98/567088098.db2.gz ZVDBHKOMOSGJMC-VQIMIIECSA-N 1 1 376.547 3.018 10 0 GGAEMO C[N@H+]1CCO[C@@H](CSCC(=O)N[C@@H](c2cccs2)c2ccccc2)C1 ZINC000565657143 567088102 /nfs/dbraw/zinc/08/81/02/567088102.db2.gz ZVDBHKOMOSGJMC-VQIMIIECSA-N 1 1 376.547 3.018 10 0 GGAEMO O=C(c1c(Cl)cc(F)cc1Br)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614108238 567088247 /nfs/dbraw/zinc/08/82/47/567088247.db2.gz VQHMLGAAKJGGCD-CHWSQXEVSA-N 1 1 393.659 3.500 10 0 GGAEMO COC(=O)[C@@]1(NCc2ncc(Cl)s2)CCC[N@H+](Cc2ccccc2)C1 ZINC000614176867 567092056 /nfs/dbraw/zinc/09/20/56/567092056.db2.gz RKVNWLSUMXRSTQ-GOSISDBHSA-N 1 1 379.913 3.094 10 0 GGAEMO COC(=O)[C@@]1(NCc2ncc(Cl)s2)CCC[N@@H+](Cc2ccccc2)C1 ZINC000614176867 567092062 /nfs/dbraw/zinc/09/20/62/567092062.db2.gz RKVNWLSUMXRSTQ-GOSISDBHSA-N 1 1 379.913 3.094 10 0 GGAEMO C[C@]1(F)C[NH2+]CCN(C(=O)CCOc2ccc(Cl)cc2Br)C1 ZINC000522001579 567093314 /nfs/dbraw/zinc/09/33/14/567093314.db2.gz GAGBDXJRDKMUPH-HNNXBMFYSA-N 1 1 393.684 3.031 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(Br)c2cc(C)oc21 ZINC000473633086 567093757 /nfs/dbraw/zinc/09/37/57/567093757.db2.gz GNHUYHNVJHGBQQ-CYBMUJFWSA-N 1 1 395.297 3.344 10 0 GGAEMO CCS(=O)(=O)C1(C[NH2+]Cc2cc(Cl)c(C)cc2Br)CC1 ZINC000657759250 567094887 /nfs/dbraw/zinc/09/48/87/567094887.db2.gz SSDPUQUXEMAWAD-UHFFFAOYSA-N 1 1 380.735 3.468 10 0 GGAEMO COc1cc(C[NH2+][C@H](CO)c2ccc(F)cc2F)cc(Br)c1O ZINC000657790078 567096967 /nfs/dbraw/zinc/09/69/67/567096967.db2.gz 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O=C(CSc1cccc(Br)c1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000684182613 567185185 /nfs/dbraw/zinc/18/51/85/567185185.db2.gz LRSHROFDVNYQEY-HUUCEWRRSA-N 1 1 387.318 3.186 10 0 GGAEMO O=C([C@@H]1CCC[N@@H+](Cc2ccc(F)c(Cl)c2Cl)C1)N1CCOCC1 ZINC000432748936 567185549 /nfs/dbraw/zinc/18/55/49/567185549.db2.gz FEWSMJYOCMKTQF-CYBMUJFWSA-N 1 1 375.271 3.203 10 0 GGAEMO O=C([C@@H]1CCC[N@H+](Cc2ccc(F)c(Cl)c2Cl)C1)N1CCOCC1 ZINC000432748936 567185552 /nfs/dbraw/zinc/18/55/52/567185552.db2.gz FEWSMJYOCMKTQF-CYBMUJFWSA-N 1 1 375.271 3.203 10 0 GGAEMO COc1c(Br)c(C)sc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000684183160 567186750 /nfs/dbraw/zinc/18/67/50/567186750.db2.gz DFBNGVALPUPCBG-MNOVXSKESA-N 1 1 391.306 3.086 10 0 GGAEMO CC(C)(C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1)c1ccc(Br)cc1 ZINC000684184234 567186894 /nfs/dbraw/zinc/18/68/94/567186894.db2.gz GRGZUOUWJKZMNT-HZPDHXFCSA-N 1 1 383.305 3.371 10 0 GGAEMO O=C(c1cc(Br)ccc1Cl)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000684185565 567187216 /nfs/dbraw/zinc/18/72/16/567187216.db2.gz YGYGROPKJFIVAS-KGLIPLIRSA-N 1 1 375.669 3.361 10 0 GGAEMO O=C(c1cc2cc(Br)ccc2o1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000684184975 567187273 /nfs/dbraw/zinc/18/72/73/567187273.db2.gz IQBILFDXFLCSNP-KGLIPLIRSA-N 1 1 381.245 3.454 10 0 GGAEMO C[C@H](C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1)c1ccc(Br)s1 ZINC000684185908 567187614 /nfs/dbraw/zinc/18/76/14/567187614.db2.gz YHYQHEBFBTUGCD-SRVKXCTJSA-N 1 1 375.307 3.259 10 0 GGAEMO O=C(c1ccc(Br)cc1Cl)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000684185709 567187642 /nfs/dbraw/zinc/18/76/42/567187642.db2.gz LCDSNVWODOPNSB-ZIAGYGMSSA-N 1 1 375.669 3.361 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)Cc2c(Br)cccc2C(=O)OC)[C@@H](C)C1 ZINC000432772306 567188465 /nfs/dbraw/zinc/18/84/65/567188465.db2.gz SJWSEGYEPUVJNA-SUMWQHHRSA-N 1 1 383.330 3.398 10 0 GGAEMO C[C@@H](CC(=O)N1CCC[C@@H]([NH+]2CCOCC2)C1)c1ccc(Br)cc1 ZINC000615548155 567188648 /nfs/dbraw/zinc/18/86/48/567188648.db2.gz SRQHZLPMDIOKQK-MAUKXSAKSA-N 1 1 395.341 3.266 10 0 GGAEMO COC(=O)c1cccc(Br)c1C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000432776546 567190743 /nfs/dbraw/zinc/19/07/43/567190743.db2.gz PBVPFOJLGLHQAR-KBPBESRZSA-N 1 1 382.298 3.484 10 0 GGAEMO C[N@H+]1CCC[C@H]1CNC(=O)Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000498646822 567192674 /nfs/dbraw/zinc/19/26/74/567192674.db2.gz OXIMMLGGLCPNOD-HNNXBMFYSA-N 1 1 379.913 3.128 10 0 GGAEMO CC(C)[C@H](O)C[N@@H+](C)Cc1cccc(Br)c1OC[C@@H]1CCCO1 ZINC000432793845 567192919 /nfs/dbraw/zinc/19/29/19/567192919.db2.gz QUCCRYKIXWNOLI-DOTOQJQBSA-N 1 1 386.330 3.456 10 0 GGAEMO COc1cccc(C[C@H](C)NC(=O)c2sc3c(c2Br)C[NH2+]C3)c1 ZINC000659248954 567193315 /nfs/dbraw/zinc/19/33/15/567193315.db2.gz JXUXWLUKIJUIJE-JTQLQIEISA-N 1 1 395.322 3.483 10 0 GGAEMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)[C@@H]1CCc3cc(Br)ccc31)C2 ZINC000615609580 567193338 /nfs/dbraw/zinc/19/33/38/567193338.db2.gz XFTHLNOZUUQINV-MJGOQNOKSA-N 1 1 377.326 3.423 10 0 GGAEMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)C1(c3ccccc3Br)CC1)C2 ZINC000615601052 567193442 /nfs/dbraw/zinc/19/34/42/567193442.db2.gz HOJLHSHPBSYHRH-GOSISDBHSA-N 1 1 377.326 3.425 10 0 GGAEMO C[N@H+]1CCC[C@H]1CNC(=O)N(Cc1cc(Br)ccc1F)C1CC1 ZINC000589771946 567193818 /nfs/dbraw/zinc/19/38/18/567193818.db2.gz PCZRCFZAVFFJNI-HNNXBMFYSA-N 1 1 384.293 3.356 10 0 GGAEMO C[NH2+][C@H](C(=O)N[C@H](C)Cc1c(C)nn(C)c1C)c1cccc(Cl)c1Cl ZINC000659252385 567194216 /nfs/dbraw/zinc/19/42/16/567194216.db2.gz QFGSNHRKKQALRG-QGHHPUGFSA-N 1 1 383.323 3.352 10 0 GGAEMO Cc1nc([C@H]2CCCCN2C(=O)c2sc3c(c2Br)C[NH2+]C3)no1 ZINC000659249729 567194272 /nfs/dbraw/zinc/19/42/72/567194272.db2.gz JONCSJUVICVVTE-SNVBAGLBSA-N 1 1 397.298 3.173 10 0 GGAEMO C[NH2+][C@@H](C(=O)N[C@H](C)Cc1c(C)nn(C)c1C)c1cccc(Cl)c1Cl ZINC000659252378 567194327 /nfs/dbraw/zinc/19/43/27/567194327.db2.gz QFGSNHRKKQALRG-BMLIUANNSA-N 1 1 383.323 3.352 10 0 GGAEMO CCC1(CC)[C@@H](NC(=O)c2sc3c(c2Br)C[NH2+]C3)C[C@@H]1OC ZINC000659245624 567194448 /nfs/dbraw/zinc/19/44/48/567194448.db2.gz ATSDUYLTJRDVIP-RYUDHWBXSA-N 1 1 387.343 3.437 10 0 GGAEMO C[C@@H](F)CCNC(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000454690612 567194524 /nfs/dbraw/zinc/19/45/24/567194524.db2.gz WQERKQZBHUCMJR-CYBMUJFWSA-N 1 1 386.309 3.461 10 0 GGAEMO COc1ccc(OC)c(NC(=O)c2sc3c(c2Br)C[NH2+]C3)c1 ZINC000659253541 567194696 /nfs/dbraw/zinc/19/46/96/567194696.db2.gz PCZMVHXOIFGTIV-UHFFFAOYSA-N 1 1 383.267 3.383 10 0 GGAEMO O=C(NC[C@@H]1OCCc2ccccc21)c1sc2c(c1Br)C[NH2+]C2 ZINC000659249619 567194719 /nfs/dbraw/zinc/19/47/19/567194719.db2.gz PXNPPKUNVJYKPR-ZDUSSCGKSA-N 1 1 393.306 3.158 10 0 GGAEMO O=C(NCCc1ccc(F)cc1F)c1sc2c(c1Br)C[NH2+]C2 ZINC000659251138 567194866 /nfs/dbraw/zinc/19/48/66/567194866.db2.gz CCTSVPRFWGQLED-UHFFFAOYSA-N 1 1 387.249 3.365 10 0 GGAEMO O=C(NC[C@@H]1CCOc2ccccc21)c1sc2c(c1Br)C[NH2+]C2 ZINC000659269387 567195586 /nfs/dbraw/zinc/19/55/86/567195586.db2.gz PIFRMDSLRRDOOZ-JTQLQIEISA-N 1 1 393.306 3.410 10 0 GGAEMO COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1C[C@@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000615635346 567195712 /nfs/dbraw/zinc/19/57/12/567195712.db2.gz RIFQBYLPJUFMIX-LGIULTMTSA-N 1 1 388.291 3.007 10 0 GGAEMO COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1C[C@@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000615635346 567195719 /nfs/dbraw/zinc/19/57/19/567195719.db2.gz RIFQBYLPJUFMIX-LGIULTMTSA-N 1 1 388.291 3.007 10 0 GGAEMO O=C(Nc1cccc2c1OCCO2)c1sc2c(c1Br)C[NH2+]C2 ZINC000659259714 567195919 /nfs/dbraw/zinc/19/59/19/567195919.db2.gz NJJJLCKAFPTDJB-UHFFFAOYSA-N 1 1 381.251 3.137 10 0 GGAEMO COc1ccc(CCNC(=O)c2sc3c(c2Br)C[NH2+]C3)cc1F ZINC000659256686 567195936 /nfs/dbraw/zinc/19/59/36/567195936.db2.gz NVWPYHMYUHDAKO-UHFFFAOYSA-N 1 1 399.285 3.234 10 0 GGAEMO Brc1cccc2c(N3CC[N@@H+]4CCOC[C@@H]4C3)cc(C3CC3)nc12 ZINC000432837789 567195883 /nfs/dbraw/zinc/19/58/83/567195883.db2.gz WFLZPMCNJKBRHS-AWEZNQCLSA-N 1 1 388.309 3.396 10 0 GGAEMO Brc1cccc2c(N3CC[N@H+]4CCOC[C@@H]4C3)cc(C3CC3)nc12 ZINC000432837789 567195889 /nfs/dbraw/zinc/19/58/89/567195889.db2.gz WFLZPMCNJKBRHS-AWEZNQCLSA-N 1 1 388.309 3.396 10 0 GGAEMO COCCC1(CNC(=O)c2sc3c(c2Br)C[NH2+]C3)CCCC1 ZINC000659259171 567196185 /nfs/dbraw/zinc/19/61/85/567196185.db2.gz ZWTQRBZZSWYQPL-UHFFFAOYSA-N 1 1 387.343 3.441 10 0 GGAEMO CN(CCOc1ccccc1F)C(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659262678 567196316 /nfs/dbraw/zinc/19/63/16/567196316.db2.gz KYZUGNNAEVLFFA-UHFFFAOYSA-N 1 1 399.285 3.404 10 0 GGAEMO CCc1ccc(C[NH+]2CCN(Cc3nn(C)cc3Br)CC2)s1 ZINC000432833469 567196374 /nfs/dbraw/zinc/19/63/74/567196374.db2.gz WTAOMSPFWYOIRW-UHFFFAOYSA-N 1 1 383.359 3.124 10 0 GGAEMO CCO[C@@H]1C[C@@H](NC(=O)c2sc3c(c2Br)C[NH2+]C3)C12CCC2 ZINC000659268668 567196416 /nfs/dbraw/zinc/19/64/16/567196416.db2.gz RTHAUCUUKRMFPJ-VXGBXAGGSA-N 1 1 385.327 3.191 10 0 GGAEMO CCO[C@@H]1C[C@@H](N(C)C(=O)c2sc3c(c2Br)C[NH2+]C3)C1(C)C ZINC000659257499 567196512 /nfs/dbraw/zinc/19/65/12/567196512.db2.gz CVUMXZXSIAISMT-VXGBXAGGSA-N 1 1 387.343 3.389 10 0 GGAEMO COCc1c(Br)cccc1NC(=O)NCC[N@@H+]1CC=C(C)CC1 ZINC000547282499 567196648 /nfs/dbraw/zinc/19/66/48/567196648.db2.gz ONONOGQTSJSKSZ-UHFFFAOYSA-N 1 1 382.302 3.369 10 0 GGAEMO CC1(C)[C@H](NC(=O)c2sc3c(c2Br)C[NH2+]C3)[C@@H]2CCCO[C@@H]21 ZINC000659268976 567196686 /nfs/dbraw/zinc/19/66/86/567196686.db2.gz VMGVHVLLUSMNHQ-PCTYZZJISA-N 1 1 385.327 3.047 10 0 GGAEMO COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1C[C@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000615635343 567196735 /nfs/dbraw/zinc/19/67/35/567196735.db2.gz RIFQBYLPJUFMIX-GNNTXSLPSA-N 1 1 388.291 3.007 10 0 GGAEMO COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1C[C@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000615635343 567196741 /nfs/dbraw/zinc/19/67/41/567196741.db2.gz RIFQBYLPJUFMIX-GNNTXSLPSA-N 1 1 388.291 3.007 10 0 GGAEMO COc1ccc(CNC(=O)c2sc3c(c2Br)C[NH2+]C3)c(F)c1 ZINC000659269357 567196808 /nfs/dbraw/zinc/19/68/08/567196808.db2.gz OSOWUGFBWIGLMH-UHFFFAOYSA-N 1 1 385.258 3.192 10 0 GGAEMO COCc1cccc(CNC(=O)c2sc3c(c2Br)C[NH2+]C3)c1 ZINC000659258394 567197008 /nfs/dbraw/zinc/19/70/08/567197008.db2.gz RKQBOMDDNHTKOM-UHFFFAOYSA-N 1 1 381.295 3.190 10 0 GGAEMO COc1ccc(CNC(=O)c2sc3c(c2Br)C[NH2+]C3)cc1F ZINC000659271799 567198075 /nfs/dbraw/zinc/19/80/75/567198075.db2.gz SKYDFLPQFHOPRW-UHFFFAOYSA-N 1 1 385.258 3.192 10 0 GGAEMO CO[C@@]1(C)C[C@@H](N(C)C(=O)c2sc3c(c2Br)C[NH2+]C3)C1(C)C ZINC000659278456 567198155 /nfs/dbraw/zinc/19/81/55/567198155.db2.gz FRICJYMEJWGVMA-BZNIZROVSA-N 1 1 387.343 3.389 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCOC[C@@H]1c1ccccc1 ZINC000659274550 567198343 /nfs/dbraw/zinc/19/83/43/567198343.db2.gz AOZFUGFQHAOUAG-CYBMUJFWSA-N 1 1 393.306 3.328 10 0 GGAEMO CN(C)C(=O)c1ccc(NC(=O)c2sc3c(c2Br)C[NH2+]C3)cc1 ZINC000659275562 567198353 /nfs/dbraw/zinc/19/83/53/567198353.db2.gz LPUCFXUEBQZPIG-UHFFFAOYSA-N 1 1 394.294 3.068 10 0 GGAEMO C[C@@H](CNC(=O)c1sc2c(c1Br)C[NH2+]C2)Oc1ccc(F)cc1 ZINC000659271313 567198571 /nfs/dbraw/zinc/19/85/71/567198571.db2.gz PAJGRLKIUZUZBN-VIFPVBQESA-N 1 1 399.285 3.450 10 0 GGAEMO COc1cc(NC(=O)NCC[N@@H+]2CC=C(C)CC2)cc(OC)c1Br ZINC000547292135 567198999 /nfs/dbraw/zinc/19/89/99/567198999.db2.gz 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C[NH+]1CCN(c2ncc(Br)cc2NC(=O)c2ccc(F)s2)CC1 ZINC000615995934 567218650 /nfs/dbraw/zinc/21/86/50/567218650.db2.gz XWCUUUYJKHHNEK-UHFFFAOYSA-N 1 1 399.289 3.049 10 0 GGAEMO C[C@H](c1cccc(Cl)c1F)[N@@H+](C)CCOc1ccc(S(N)(=O)=O)cc1 ZINC000433063038 567219332 /nfs/dbraw/zinc/21/93/32/567219332.db2.gz WIIXHILBECUGID-GFCCVEGCSA-N 1 1 386.876 3.198 10 0 GGAEMO Cc1cc(C)c(NC(=O)NC[C@@H]2CCCC[N@H+]2CCO)c(Br)c1 ZINC000454990402 567220135 /nfs/dbraw/zinc/22/01/35/567220135.db2.gz KSQJHYOFTANIOF-AWEZNQCLSA-N 1 1 384.318 3.034 10 0 GGAEMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)c1cc(C)ccc1I ZINC000590345146 567221431 /nfs/dbraw/zinc/22/14/31/567221431.db2.gz UAZDAURNNNQODD-CYBMUJFWSA-N 1 1 386.277 3.156 10 0 GGAEMO CC[N@@H+](C)CCNC(=O)c1cc(Oc2cccc(Br)c2)ccn1 ZINC000475047278 567222368 /nfs/dbraw/zinc/22/23/68/567222368.db2.gz GOASVROEKNZYBQ-UHFFFAOYSA-N 1 1 378.270 3.318 10 0 GGAEMO COC[C@@H]1CCC[N@@H+](CCCOc2cccc(I)c2)C1 ZINC000499077151 567222664 /nfs/dbraw/zinc/22/26/64/567222664.db2.gz 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C[C@](CO)(NC(=O)Cn1c[nH+]c2c1CCCC2)c1cc(Cl)cc(Cl)c1 ZINC000616079776 567225471 /nfs/dbraw/zinc/22/54/71/567225471.db2.gz JZAYHSLVNINNNF-GOSISDBHSA-N 1 1 382.291 3.093 10 0 GGAEMO CO[C@@H]1C[N@@H+](Cc2ccc(Br)cc2N2CCOCC2)CC[C@H]1C ZINC000475127659 567227706 /nfs/dbraw/zinc/22/77/06/567227706.db2.gz DEGWVSDTPWPFTH-RDTXWAMCSA-N 1 1 383.330 3.143 10 0 GGAEMO COc1ccc(Br)c2[nH]c(C(=O)N(C)[C@H]3CC[N@@H+](C)[C@@H](C)C3)cc21 ZINC000525106715 567229345 /nfs/dbraw/zinc/22/93/45/567229345.db2.gz YJWFMVBQRNQUME-RYUDHWBXSA-N 1 1 394.313 3.494 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)NCC[N@@H+](C)Cc1ccccc1 ZINC000525136793 567229385 /nfs/dbraw/zinc/22/93/85/567229385.db2.gz GPGXEUZWOXULAE-UHFFFAOYSA-N 1 1 391.309 3.248 10 0 GGAEMO COc1ccc(CCC(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)c(Br)c1 ZINC000616155406 567230098 /nfs/dbraw/zinc/23/00/98/567230098.db2.gz KATQTQLHGAUPFJ-HNNXBMFYSA-N 1 1 383.330 3.331 10 0 GGAEMO CCC[N@H+](CCN1C(=O)CN(C)C1=O)[C@H](C)c1ccccc1Br ZINC000659844353 567230706 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ZINC000476943464 567360298 /nfs/dbraw/zinc/36/02/98/567360298.db2.gz UXELIIDBCRVINK-KRWDZBQOSA-N 1 1 377.282 3.053 10 0 GGAEMO C[C@@H]1[C@H](C(=O)N2CCC[C@H]2c2ccccc2I)CC[N@H+]1C ZINC000592764673 567361030 /nfs/dbraw/zinc/36/10/30/567361030.db2.gz ZMAMWFVAASEMBC-IOASZLSFSA-N 1 1 398.288 3.295 10 0 GGAEMO COCC[N@H+]1CC[C@H](NC(=O)N2CCc3cc(Cl)cc(Cl)c3[C@H]2C)C1 ZINC000435417716 567361215 /nfs/dbraw/zinc/36/12/15/567361215.db2.gz NBZPFGBPPOQRMW-DOMZBBRYSA-N 1 1 386.323 3.343 10 0 GGAEMO COCC[N@H+]1CC[C@H](NC(=O)N2CCc3cc(Cl)cc(Cl)c3[C@@H]2C)C1 ZINC000435417719 567361624 /nfs/dbraw/zinc/36/16/24/567361624.db2.gz NBZPFGBPPOQRMW-WFASDCNBSA-N 1 1 386.323 3.343 10 0 GGAEMO OC1([C@@H]2CCCC[N@@H+]2Cc2nc(-c3cc(Br)cs3)no2)CC1 ZINC000568848012 567361777 /nfs/dbraw/zinc/36/17/77/567361777.db2.gz SLTZHKJZFDFGGX-LBPRGKRZSA-N 1 1 384.299 3.440 10 0 GGAEMO OC1([C@@H]2CCCC[N@H+]2Cc2nc(-c3cc(Br)cs3)no2)CC1 ZINC000568848012 567361782 /nfs/dbraw/zinc/36/17/82/567361782.db2.gz SLTZHKJZFDFGGX-LBPRGKRZSA-N 1 1 384.299 3.440 10 0 GGAEMO O[C@H]1CC[N@@H+](Cc2ccccc2CNCc2ccsc2Br)C1 ZINC000527691168 567361918 /nfs/dbraw/zinc/36/19/18/567361918.db2.gz LMJGMMFCSICWNZ-INIZCTEOSA-N 1 1 381.339 3.367 10 0 GGAEMO O=C1[C@H]([NH2+]Cc2ccc(Br)c(F)c2F)CCCN1c1cccnc1 ZINC000527692745 567363165 /nfs/dbraw/zinc/36/31/65/567363165.db2.gz UEGQNXKCFGZYKX-CQSZACIVSA-N 1 1 396.235 3.408 10 0 GGAEMO O=C(C[N@@H+]1CCC[C@]2(CCCOC2)C1)Nc1ccc(Br)cc1F ZINC000477042664 567366972 /nfs/dbraw/zinc/36/69/72/567366972.db2.gz JMCOPULIBZJNCY-KRWDZBQOSA-N 1 1 385.277 3.419 10 0 GGAEMO O=C(C[N@H+]1CCC[C@]2(CCCOC2)C1)Nc1ccc(Br)cc1F ZINC000477042664 567366977 /nfs/dbraw/zinc/36/69/77/567366977.db2.gz JMCOPULIBZJNCY-KRWDZBQOSA-N 1 1 385.277 3.419 10 0 GGAEMO O=C(C[N@@H+]1CCC[C@@]2(CCCOC2)C1)Nc1ccc(Br)cc1F ZINC000477042665 567367245 /nfs/dbraw/zinc/36/72/45/567367245.db2.gz JMCOPULIBZJNCY-QGZVFWFLSA-N 1 1 385.277 3.419 10 0 GGAEMO O=C(C[N@H+]1CCC[C@@]2(CCCOC2)C1)Nc1ccc(Br)cc1F ZINC000477042665 567367249 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COCC[N@H+]1CCC[C@H]1CNC(=O)N1CCc2c(ccc(Cl)c2Cl)C1 ZINC000477105224 567371153 /nfs/dbraw/zinc/37/11/53/567371153.db2.gz BAQUTCYVBIMIRO-AWEZNQCLSA-N 1 1 386.323 3.172 10 0 GGAEMO CO[C@]1(CO)CCC[N@H+]([C@@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2Cl)C1 ZINC000661396914 567371466 /nfs/dbraw/zinc/37/14/66/567371466.db2.gz UFLPFVXLGKRSKX-FHSNZYRGSA-N 1 1 389.323 3.032 10 0 GGAEMO C[C@@H]([NH2+]C[C@@H](O)COc1cc(F)cc(Br)c1)c1cscn1 ZINC000661421810 567373175 /nfs/dbraw/zinc/37/31/75/567373175.db2.gz WYGVWHYEBJERIJ-BXKDBHETSA-N 1 1 375.263 3.135 10 0 GGAEMO CC(C)[N@H+]1CC[C@@H](CNC(=O)NCc2cc(F)c(Br)cc2F)C1 ZINC000527802292 567374846 /nfs/dbraw/zinc/37/48/46/567374846.db2.gz ZHDKZCIAXBUPIH-NSHDSACASA-N 1 1 390.272 3.257 10 0 GGAEMO C[C@@H](NC(=O)N[C@@H]1CCC[N@@H+](C)C1)c1cc(F)c(Br)cc1F ZINC000527797897 567375250 /nfs/dbraw/zinc/37/52/50/567375250.db2.gz DNYOFYFCLVQULL-NXEZZACHSA-N 1 1 376.245 3.182 10 0 GGAEMO COC(=O)c1ccc(Br)cc1C[NH+]1CCC2(C[C@H]2C(=O)OC)CC1 ZINC000549138276 567375620 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O=C(N[C@H]1CSCc2ccc(Br)cc21)[C@H]1CCC[N@H+]1C1CC1 ZINC000618360148 567378301 /nfs/dbraw/zinc/37/83/01/567378301.db2.gz KZEOVVJQSOPTRC-JKSUJKDBSA-N 1 1 381.339 3.480 10 0 GGAEMO NC(=O)c1ncc(Br)cc1NC[C@@H]1CCC[N@H+]1C1CCCCC1 ZINC000435597721 567378677 /nfs/dbraw/zinc/37/86/77/567378677.db2.gz NOTPKYCJOLAZGY-AWEZNQCLSA-N 1 1 381.318 3.152 10 0 GGAEMO CCN(Cc1cccc(Br)c1)C(=O)NC[C@@H]1CCC[N@H+]1CCOC ZINC000477185000 567379330 /nfs/dbraw/zinc/37/93/30/567379330.db2.gz GWLHTPUZMFPHGO-KRWDZBQOSA-N 1 1 398.345 3.091 10 0 GGAEMO C[C@H](C(=O)N[C@@H]1C[C@H]([NH+]2CCOCC2)C1(C)C)c1cccc(Br)c1 ZINC000640512802 567382023 /nfs/dbraw/zinc/38/20/23/567382023.db2.gz CBBPEKNCFOUPGI-XKQJLSEDSA-N 1 1 395.341 3.168 10 0 GGAEMO C[C@H](C(=O)N[C@H]1C[C@H]([NH+]2CCOCC2)C1(C)C)c1cccc(Br)c1 ZINC000640512798 567382189 /nfs/dbraw/zinc/38/21/89/567382189.db2.gz CBBPEKNCFOUPGI-JQFCIGGWSA-N 1 1 395.341 3.168 10 0 GGAEMO C[C@H]1C[C@@H](C(=O)N2CCOC[C@H]2c2ccc(Br)cc2)CC[N@H+]1C ZINC000618364499 567382509 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384.299 3.298 10 0 GGAEMO O[C@@]1(C2CC2)CCC[N@@H+](Cc2nc(-c3ccc(Br)s3)no2)C1 ZINC000661631055 567384504 /nfs/dbraw/zinc/38/45/04/567384504.db2.gz XUGWWXYQRPJBCL-HNNXBMFYSA-N 1 1 384.299 3.298 10 0 GGAEMO C[C@@H]1C[N@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C[C@H](C)[C@H]1O ZINC000661624531 567384560 /nfs/dbraw/zinc/38/45/60/567384560.db2.gz KBYGMLDHFGVLQK-LAQFHYBYSA-N 1 1 376.298 3.355 10 0 GGAEMO O[C@H](C[NH2+][C@H](c1ccc(Br)o1)c1ccc(F)cc1)[C@H]1CCCO1 ZINC000527955313 567386268 /nfs/dbraw/zinc/38/62/68/567386268.db2.gz QWXJPZDRVVFMGI-CPUCHLNUSA-N 1 1 384.245 3.400 10 0 GGAEMO C[C@@H](NC(=O)N1CC[NH2+]C[C@H]1c1cccnc1)c1ccc(Br)cc1 ZINC000569204736 567386322 /nfs/dbraw/zinc/38/63/22/567386322.db2.gz PNKFMSZZEZGBHD-DYVFJYSZSA-N 1 1 389.297 3.261 10 0 GGAEMO C[N@@H+](CCCNC(=O)Cc1ccc(Br)cc1O)Cc1ccccc1 ZINC000477296236 567386703 /nfs/dbraw/zinc/38/67/03/567386703.db2.gz SCRILEWOLJYQKB-UHFFFAOYSA-N 1 1 391.309 3.336 10 0 GGAEMO C[C@@H]([NH2+]C[C@@H]1c2ccccc2C(=O)N1C)c1ncc(Br)cc1F ZINC000527999435 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ZINC000528465349 567426529 /nfs/dbraw/zinc/42/65/29/567426529.db2.gz IKGCUFAYFTZHCS-SFHVURJKSA-N 1 1 384.351 3.164 10 0 GGAEMO O=C(C[N@H+]1C[C@]23COC[C@@]2(C1)CCCC3)Nc1ccc(Br)cc1F ZINC000662317245 567426900 /nfs/dbraw/zinc/42/69/00/567426900.db2.gz WKEONOWXLPZFBF-HDICACEKSA-N 1 1 397.288 3.419 10 0 GGAEMO O=C(C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3)Nc1ccc(Br)cc1F ZINC000662317245 567426905 /nfs/dbraw/zinc/42/69/05/567426905.db2.gz WKEONOWXLPZFBF-HDICACEKSA-N 1 1 397.288 3.419 10 0 GGAEMO C[C@@H](CCc1ccc(I)cc1)[NH2+][C@H]1CCc2[nH]cnc2C1 ZINC000569746752 567428065 /nfs/dbraw/zinc/42/80/65/567428065.db2.gz DKDBHKVSVHGSFN-WFASDCNBSA-N 1 1 395.288 3.483 10 0 GGAEMO COc1ccc(OC)c([C@H](C)NC(=O)[C@@H]([NH3+])c2ccccc2Br)c1 ZINC000662352054 567428703 /nfs/dbraw/zinc/42/87/03/567428703.db2.gz RJOLGIUQWUDNAA-GTNSWQLSSA-N 1 1 393.281 3.344 10 0 GGAEMO C[C@H]1C[C@@H](C(=O)Nc2cc(F)c(I)c(F)c2)CC[N@H+]1C ZINC000550142480 567429438 /nfs/dbraw/zinc/42/94/38/567429438.db2.gz RRVOBVWRVMJZPT-IUCAKERBSA-N 1 1 394.203 3.238 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCC[C@@H]1c1ccncc1 ZINC000662368368 567429735 /nfs/dbraw/zinc/42/97/35/567429735.db2.gz RBMYXQCFMSYLKH-GFCCVEGCSA-N 1 1 378.295 3.486 10 0 GGAEMO C/C(=C/c1ccccc1C(F)(F)F)C[N@H+]1CCC[C@@H](CS(N)(=O)=O)C1 ZINC000502344834 567429708 /nfs/dbraw/zinc/42/97/08/567429708.db2.gz KAVKTFBEEOFTMW-RNQWEJQRSA-N 1 1 376.444 3.109 10 0 GGAEMO C[NH+](C)[C@H](CNC(=O)Nc1cnc2c(Br)cccn12)c1ccco1 ZINC000436498623 567430080 /nfs/dbraw/zinc/43/00/80/567430080.db2.gz PDPXZBCTNCZCMQ-GFCCVEGCSA-N 1 1 392.257 3.114 10 0 GGAEMO C[C@@]1(C(F)F)C[N@H+](CCC(=O)Nc2cccc(Br)c2)CCO1 ZINC000662372168 567430112 /nfs/dbraw/zinc/43/01/12/567430112.db2.gz PZNUETYKNLUHGA-HNNXBMFYSA-N 1 1 377.229 3.134 10 0 GGAEMO C[C@@]1(C(F)F)C[N@@H+](CCC(=O)Nc2cccc(Br)c2)CCO1 ZINC000662372168 567430119 /nfs/dbraw/zinc/43/01/19/567430119.db2.gz PZNUETYKNLUHGA-HNNXBMFYSA-N 1 1 377.229 3.134 10 0 GGAEMO C[C@H](Oc1ccccc1Br)C(=O)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000456982834 567430214 /nfs/dbraw/zinc/43/02/14/567430214.db2.gz GUIMNLKZNXMDKU-WMLDXEAASA-N 1 1 389.293 3.390 10 0 GGAEMO C[C@@H](Oc1ccccc1Br)C(=O)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000456982830 567430237 /nfs/dbraw/zinc/43/02/37/567430237.db2.gz GUIMNLKZNXMDKU-PBHICJAKSA-N 1 1 389.293 3.390 10 0 GGAEMO COc1ccc(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)cc1Br ZINC000456981557 567430327 /nfs/dbraw/zinc/43/03/27/567430327.db2.gz FWCQRESWOGTDGX-INIZCTEOSA-N 1 1 375.266 3.244 10 0 GGAEMO COc1ccc(Cl)cc1NC(=O)CC[N@@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC000662366201 567430190 /nfs/dbraw/zinc/43/01/90/567430190.db2.gz VWJWKGQZSXPWBB-PIGZYNQJSA-N 1 1 376.831 3.422 10 0 GGAEMO COc1ccc(Cl)cc1NC(=O)CC[N@H+]1C[C@@H](C)O[C@@](C)(C(F)F)C1 ZINC000662366201 567430197 /nfs/dbraw/zinc/43/01/97/567430197.db2.gz VWJWKGQZSXPWBB-PIGZYNQJSA-N 1 1 376.831 3.422 10 0 GGAEMO Cc1c[nH+]cn1CC(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000528501551 567430241 /nfs/dbraw/zinc/43/02/41/567430241.db2.gz LWRRCPGPQVSKRN-UHFFFAOYSA-N 1 1 381.307 3.279 10 0 GGAEMO C[C@]1(Br)C[C@H]1C(=O)NCC1([N@H+]2CCOC(C)(C)C2)CCCCC1 ZINC000528497787 567430347 /nfs/dbraw/zinc/43/03/47/567430347.db2.gz RYAAYDFYGLCMFX-YOEHRIQHSA-N 1 1 387.362 3.090 10 0 GGAEMO COc1ccc(NC(=O)CC[N@@H+]2C[C@@H](C)O[C@@](C)(C(F)F)C2)cc1Cl ZINC000662362566 567430314 /nfs/dbraw/zinc/43/03/14/567430314.db2.gz QHMOUXHWMAZILB-PIGZYNQJSA-N 1 1 376.831 3.422 10 0 GGAEMO COc1ccc(NC(=O)CC[N@H+]2C[C@@H](C)O[C@@](C)(C(F)F)C2)cc1Cl ZINC000662362566 567430318 /nfs/dbraw/zinc/43/03/18/567430318.db2.gz QHMOUXHWMAZILB-PIGZYNQJSA-N 1 1 376.831 3.422 10 0 GGAEMO C[NH2+][C@H](C(=O)NC1CCN(C(=O)C(C)C)CC1)c1cccc(Cl)c1Cl ZINC000662378738 567431031 /nfs/dbraw/zinc/43/10/31/567431031.db2.gz IAWNUGSZJUYOCF-INIZCTEOSA-N 1 1 386.323 3.017 10 0 GGAEMO C[N@H+]1CC[C@H](NC(=O)c2ccc(Br)cc2O)[C@H]1c1ccccc1 ZINC000436524733 567431120 /nfs/dbraw/zinc/43/11/20/567431120.db2.gz KJKBJQGNVUORHO-DOTOQJQBSA-N 1 1 375.266 3.330 10 0 GGAEMO CO[C@H](CNC(=O)c1sc2c(c1Br)C[NH2+]C2)c1ccccc1 ZINC000662376022 567431326 /nfs/dbraw/zinc/43/13/26/567431326.db2.gz SDTKUQMPEXQUOS-GFCCVEGCSA-N 1 1 381.295 3.231 10 0 GGAEMO C[C@@H]1CCCC[C@@H]1OCCNC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000662387175 567431409 /nfs/dbraw/zinc/43/14/09/567431409.db2.gz CBGITUKINBYIPJ-PWSUYJOCSA-N 1 1 387.343 3.439 10 0 GGAEMO Cc1cc([C@@H]2CCCN2C(=O)c2sc3c(c2Br)C[NH2+]C3)on1 ZINC000662388955 567431525 /nfs/dbraw/zinc/43/15/25/567431525.db2.gz RCVNFWXQSLUCPN-JTQLQIEISA-N 1 1 382.283 3.388 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCc2ccc(O)cc2C1 ZINC000662383521 567431736 /nfs/dbraw/zinc/43/17/36/567431736.db2.gz AVKPCAONLLDFPX-UHFFFAOYSA-N 1 1 379.279 3.018 10 0 GGAEMO C[C@@H](CNC(=O)c1sc2c(c1Br)C[NH2+]C2)N(C)c1ccccc1 ZINC000662387972 567432174 /nfs/dbraw/zinc/43/21/74/567432174.db2.gz NNKQMEYZUKADLF-NSHDSACASA-N 1 1 394.338 3.369 10 0 GGAEMO C[N@H+]1CC[C@@H](NC(=O)c2cc(Br)ccc2O)[C@H]1c1ccccc1 ZINC000436524312 567432247 /nfs/dbraw/zinc/43/22/47/567432247.db2.gz GOMWKQRISGKBCR-NVXWUHKLSA-N 1 1 375.266 3.330 10 0 GGAEMO O=C(Cc1ccc(F)c(Br)c1)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000456999794 567432279 /nfs/dbraw/zinc/43/22/79/567432279.db2.gz UGIBFRXDKVUFHZ-QGZVFWFLSA-N 1 1 377.257 3.304 10 0 GGAEMO O=C(Cc1cc(F)ccc1Br)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000457021530 567432808 /nfs/dbraw/zinc/43/28/08/567432808.db2.gz MMHDFZXAVDQPHA-KRWDZBQOSA-N 1 1 377.257 3.304 10 0 GGAEMO O=C(Cc1cc(F)ccc1Br)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000457021531 567432835 /nfs/dbraw/zinc/43/28/35/567432835.db2.gz MMHDFZXAVDQPHA-QGZVFWFLSA-N 1 1 377.257 3.304 10 0 GGAEMO O[C@@H](COc1cc(F)ccc1Br)C[N@H+]1CCc2ccccc2C1 ZINC000550177520 567432878 /nfs/dbraw/zinc/43/28/78/567432878.db2.gz ZHXDDLDKZVFQCY-MRXNPFEDSA-N 1 1 380.257 3.386 10 0 GGAEMO Cc1nc2ccc(Br)cn2c1C(=O)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000457033642 567434392 /nfs/dbraw/zinc/43/43/92/567434392.db2.gz VGLWKTRNNHWWSZ-MRXNPFEDSA-N 1 1 399.292 3.192 10 0 GGAEMO O=C(N[C@H]1CCCc2[nH]c(=O)ccc21)c1sc2c(c1Br)C[NH2+]C2 ZINC000662418425 567435247 /nfs/dbraw/zinc/43/52/47/567435247.db2.gz PVNGVKMUCYPCFL-NSHDSACASA-N 1 1 394.294 3.022 10 0 GGAEMO O=C(N[C@@H]1CCCc2[nH]c(=O)ccc21)c1sc2c(c1Br)C[NH2+]C2 ZINC000662418424 567435396 /nfs/dbraw/zinc/43/53/96/567435396.db2.gz PVNGVKMUCYPCFL-LLVKDONJSA-N 1 1 394.294 3.022 10 0 GGAEMO C[NH+](C)C[C@@H](NS(=O)(=O)c1cccc(N)c1)c1ccc(Cl)c(Cl)c1 ZINC000528550128 567436872 /nfs/dbraw/zinc/43/68/72/567436872.db2.gz UCFVRFIRONJPDD-MRXNPFEDSA-N 1 1 388.320 3.157 10 0 GGAEMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000457079097 567438008 /nfs/dbraw/zinc/43/80/08/567438008.db2.gz BFZCVNOJJIRHHP-LLVKDONJSA-N 1 1 375.257 3.211 10 0 GGAEMO COc1ccccc1CCN(C)C(=O)[C@H]([NH3+])c1ccccc1Br ZINC000662445194 567438247 /nfs/dbraw/zinc/43/82/47/567438247.db2.gz FKZFHXBHILEDBT-QGZVFWFLSA-N 1 1 377.282 3.159 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)[C@H]3C[C@@H]3c3cc(Cl)cc(Cl)c3)[C@H]2C1 ZINC000502516140 567439717 /nfs/dbraw/zinc/43/97/17/567439717.db2.gz JHMPMHOWRPNWOJ-VSZNYVQBSA-N 1 1 383.319 3.419 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)[C@@H]3C[C@@H]3c3cc(Cl)cc(Cl)c3)[C@H]2C1 ZINC000502516143 567439771 /nfs/dbraw/zinc/43/97/71/567439771.db2.gz JHMPMHOWRPNWOJ-ZJPYXAASSA-N 1 1 383.319 3.419 10 0 GGAEMO O=C(c1sc2c(c1Br)CNC2)N1CCC[N@H+](C2CCCC2)CC1 ZINC000662468795 567439870 /nfs/dbraw/zinc/43/98/70/567439870.db2.gz SQPMWCAMIVFXGU-UHFFFAOYSA-N 1 1 398.370 3.204 10 0 GGAEMO CC(C)[C@H]1CN(C(=O)c2sc3c(c2Br)C[NH2+]C3)CCS1 ZINC000662484395 567441596 /nfs/dbraw/zinc/44/15/96/567441596.db2.gz JKBJCXMVPUXHRG-LLVKDONJSA-N 1 1 375.357 3.327 10 0 GGAEMO Cc1nn(C)cc1[C@@H]1CCCN1C(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000662499391 567441894 /nfs/dbraw/zinc/44/18/94/567441894.db2.gz ADEYWSPUNVIBQX-LBPRGKRZSA-N 1 1 395.326 3.133 10 0 GGAEMO O=C(Nc1cc(C(F)(F)F)[nH]n1)c1sc2c(c1Br)C[NH2+]C2 ZINC000662501272 567442903 /nfs/dbraw/zinc/44/29/03/567442903.db2.gz DNLUFWJCPBTXKV-UHFFFAOYSA-N 1 1 381.177 3.108 10 0 GGAEMO OC[C@@H]1CCC2(CCOCC2)C[N@H+]1Cc1nc2ccc(Br)cc2o1 ZINC000528645837 567444418 /nfs/dbraw/zinc/44/44/18/567444418.db2.gz QGJGKJCQHUZAJR-AWEZNQCLSA-N 1 1 395.297 3.344 10 0 GGAEMO C[C@H]1CC[N@@H+](CC(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)C1 ZINC000569939015 567444864 /nfs/dbraw/zinc/44/48/64/567444864.db2.gz GZRXVULWXIOPNG-AWEZNQCLSA-N 1 1 384.351 3.416 10 0 GGAEMO COc1ccc(C[N@H+]2CC3(CCOCC3)CC[C@H]2CO)c(Br)c1 ZINC000528636897 567444890 /nfs/dbraw/zinc/44/48/90/567444890.db2.gz FLKMZBSLIYFART-HNNXBMFYSA-N 1 1 384.314 3.211 10 0 GGAEMO C[N@@H+](CCCCNC(=O)c1c(F)cccc1I)C1CC1 ZINC000457161158 567445209 /nfs/dbraw/zinc/44/52/09/567445209.db2.gz CZSJNIPKEXSZAW-UHFFFAOYSA-N 1 1 390.240 3.035 10 0 GGAEMO O=C(N[C@@H]1C[C@@]1(F)c1ccccc1)c1sc2c(c1Br)C[NH2+]C2 ZINC000662520571 567445084 /nfs/dbraw/zinc/44/50/84/567445084.db2.gz BSXJBCRATLCIMT-MLGOLLRUSA-N 1 1 381.270 3.481 10 0 GGAEMO COc1ccc(C[N@H+]2CC3(CCOCC3)CC[C@@H]2CO)c(Br)c1 ZINC000528636901 567445172 /nfs/dbraw/zinc/44/51/72/567445172.db2.gz FLKMZBSLIYFART-OAHLLOKOSA-N 1 1 384.314 3.211 10 0 GGAEMO O=C(N[C@H]1C[C@@]1(F)c1ccccc1)c1sc2c(c1Br)C[NH2+]C2 ZINC000662520563 567445250 /nfs/dbraw/zinc/44/52/50/567445250.db2.gz BSXJBCRATLCIMT-BLLLJJGKSA-N 1 1 381.270 3.481 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCOc2cccc(F)c2C1 ZINC000662542766 567446026 /nfs/dbraw/zinc/44/60/26/567446026.db2.gz AXBPTHGCWRBDTE-UHFFFAOYSA-N 1 1 397.269 3.288 10 0 GGAEMO O=C(NCCCNc1cccc(F)c1)c1sc2c(c1Br)C[NH2+]C2 ZINC000662540043 567446575 /nfs/dbraw/zinc/44/65/75/567446575.db2.gz AJHPNIQGVOUUMI-UHFFFAOYSA-N 1 1 398.301 3.485 10 0 GGAEMO O=C(NC[C@@H](CCO)c1ccccc1)c1sc2c(c1Br)C[NH2+]C2 ZINC000662531389 567446671 /nfs/dbraw/zinc/44/66/71/567446671.db2.gz UTQDKRSOJOYECM-GFCCVEGCSA-N 1 1 395.322 3.010 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)C(C)(C)c3ccccc3Br)[C@H]2C1 ZINC000502664639 567447256 /nfs/dbraw/zinc/44/72/56/567447256.db2.gz QWCHBAVKDHVNEF-DLBZAZTESA-N 1 1 395.341 3.048 10 0 GGAEMO Cc1cc(C2CCN(C(=O)c3sc4c(c3Br)C[NH2+]C4)CC2)[nH]n1 ZINC000662543610 567447907 /nfs/dbraw/zinc/44/79/07/567447907.db2.gz WXYKUYZBDOHNGE-UHFFFAOYSA-N 1 1 395.326 3.165 10 0 GGAEMO CCc1sc(C(=O)N2CCO[C@@H]3CC[N@H+](CC)C[C@@H]32)cc1Br ZINC000502749121 567448222 /nfs/dbraw/zinc/44/82/22/567448222.db2.gz MNBOJRDAJGUNDF-QWHCGFSZSA-N 1 1 387.343 3.008 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)[C@H]3C[C@H]3c3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000502738911 567448446 /nfs/dbraw/zinc/44/84/46/567448446.db2.gz QGOKNBPGFFYHIH-DFEHZGFQSA-N 1 1 383.319 3.419 10 0 GGAEMO Cc1cc(Cl)ccc1C1=CC[N@@H+](C[C@H]2CCCN(S(C)(=O)=O)C2)CC1 ZINC000528739980 567450672 /nfs/dbraw/zinc/45/06/72/567450672.db2.gz DOIMVNWSDDPKFH-MRXNPFEDSA-N 1 1 382.957 3.409 10 0 GGAEMO CC1(N2CCOCC2)CC[NH+](Cc2nc3cc(Br)ccc3o2)CC1 ZINC000528727959 567450751 /nfs/dbraw/zinc/45/07/51/567450751.db2.gz XRSFPZJOIOHQGD-UHFFFAOYSA-N 1 1 394.313 3.277 10 0 GGAEMO [NH3+][C@H](C(=O)NCC[C@H]1CCc2ccccc2N1)c1ccccc1Br ZINC000662585797 567450955 /nfs/dbraw/zinc/45/09/55/567450955.db2.gz XXRLRPSBHPVAIM-KDOFPFPSSA-N 1 1 388.309 3.382 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCC[C@@H](OC2CCC2)C1 ZINC000662582964 567451292 /nfs/dbraw/zinc/45/12/92/567451292.db2.gz CDKGTGBXLKRROH-LLVKDONJSA-N 1 1 385.327 3.288 10 0 GGAEMO [NH3+][C@H](C(=O)N[C@H](C[C@@H]1CCCO1)C(F)(F)F)c1ccccc1Br ZINC000662585826 567451556 /nfs/dbraw/zinc/45/15/56/567451556.db2.gz MDAAZBVSWYPFEB-BIMULSAOSA-N 1 1 395.219 3.065 10 0 GGAEMO COc1cccc(C(=O)Nc2ccc(C[NH+](C)C)c(Br)c2)c1O ZINC000436794648 567452599 /nfs/dbraw/zinc/45/25/99/567452599.db2.gz WBKXSCVNGJJTFT-UHFFFAOYSA-N 1 1 379.254 3.477 10 0 GGAEMO C[C@H]1O[C@@H](C)[C@H](C)[C@H]1[NH2+]Cc1nc(Cc2cccc(Br)c2)no1 ZINC000528754186 567452675 /nfs/dbraw/zinc/45/26/75/567452675.db2.gz IAULSLXXILTDCY-KVFJLYFUSA-N 1 1 380.286 3.324 10 0 GGAEMO O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662596704 567452868 /nfs/dbraw/zinc/45/28/68/567452868.db2.gz JRFAITBWHKFGGY-ZDUSSCGKSA-N 1 1 391.313 3.177 10 0 GGAEMO C[NH+](C)C[C@H](N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccc(Cl)c(Cl)c1 ZINC000528766518 567452811 /nfs/dbraw/zinc/45/28/11/567452811.db2.gz NLFAIIFPJLPOKJ-KBPBESRZSA-N 1 1 398.256 3.349 10 0 GGAEMO O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662596701 567452909 /nfs/dbraw/zinc/45/29/09/567452909.db2.gz JRFAITBWHKFGGY-CYBMUJFWSA-N 1 1 391.313 3.177 10 0 GGAEMO C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1[NH2+]Cc1nc(Cc2cccc(Br)c2)no1 ZINC000528754187 567453036 /nfs/dbraw/zinc/45/30/36/567453036.db2.gz IAULSLXXILTDCY-PXDYOCJYSA-N 1 1 380.286 3.324 10 0 GGAEMO [NH3+][C@@H](C(=O)NCc1cccc(OC2CC2)c1F)c1ccccc1Br ZINC000662644981 567454367 /nfs/dbraw/zinc/45/43/67/567454367.db2.gz GULFXIVIWKIXNO-QGZVFWFLSA-N 1 1 393.256 3.446 10 0 GGAEMO O=C(CC[N@H+]1CC[C@H]2CC[C@@H](C1)[S@@]2=O)Nc1c(Cl)cccc1Cl ZINC000528781012 567454519 /nfs/dbraw/zinc/45/45/19/567454519.db2.gz BYRPXMAFUWWGCW-YCDSQXFLSA-N 1 1 375.321 3.307 10 0 GGAEMO O=C(CC[N@H+]1CC[C@H]2CC[C@@H](C1)[S@]2=O)Nc1c(Cl)cccc1Cl ZINC000528781024 567454968 /nfs/dbraw/zinc/45/49/68/567454968.db2.gz BYRPXMAFUWWGCW-WCBZVUCDSA-N 1 1 375.321 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Cc1cc(NC(=O)[C@H](C)[N@@H+]2CC[C@H]3CC[C@@H](C2)[S@@]3=O)ccc1Br ZINC000528784102 567456946 /nfs/dbraw/zinc/45/69/46/567456946.db2.gz IYPXRMOFZWSNRD-BBIVEYOYSA-N 1 1 399.354 3.070 10 0 GGAEMO Cc1cc(NC(=O)[C@H](C)[N@H+]2CC[C@H]3CC[C@@H](C2)[S@@]3=O)ccc1Br ZINC000528784102 567456949 /nfs/dbraw/zinc/45/69/49/567456949.db2.gz IYPXRMOFZWSNRD-BBIVEYOYSA-N 1 1 399.354 3.070 10 0 GGAEMO C[C@H](NC(=O)C[N@@H+]1CC[C@H]2CC[C@@H](C1)[S@@]2=O)c1ccc(Cl)cc1Cl ZINC000528790032 567457167 /nfs/dbraw/zinc/45/71/67/567457167.db2.gz XYUPGNDWBQLZJP-GJDJCMNRSA-N 1 1 389.348 3.156 10 0 GGAEMO C[C@H](NC(=O)C[N@H+]1CC[C@H]2CC[C@@H](C1)[S@@]2=O)c1ccc(Cl)cc1Cl ZINC000528790032 567457174 /nfs/dbraw/zinc/45/71/74/567457174.db2.gz XYUPGNDWBQLZJP-GJDJCMNRSA-N 1 1 389.348 3.156 10 0 GGAEMO O=C(CC[N@H+]1CCC[C@H]1c1ccc(=O)[nH]n1)Nc1ccc(Br)cc1 ZINC000528792851 567457236 /nfs/dbraw/zinc/45/72/36/567457236.db2.gz JRWMBOAATCUUGE-HNNXBMFYSA-N 1 1 391.269 3.110 10 0 GGAEMO O=C(CC[N@H+]1CCC[C@@H]1c1ccc(=O)[nH]n1)Nc1ccccc1Br ZINC000528798513 567458837 /nfs/dbraw/zinc/45/88/37/567458837.db2.gz YVBZOZNRRHZQDC-OAHLLOKOSA-N 1 1 391.269 3.110 10 0 GGAEMO Cc1ccc(NCCCNC(=O)c2sc3c(c2Br)C[NH2+]C3)nc1 ZINC000662737229 567459685 /nfs/dbraw/zinc/45/96/85/567459685.db2.gz WXRASTMGWBONIL-UHFFFAOYSA-N 1 1 395.326 3.049 10 0 GGAEMO Cc1ccc(NCCCNC(=O)c2sc3c(c2Br)CNC3)[nH+]c1 ZINC000662737229 567459690 /nfs/dbraw/zinc/45/96/90/567459690.db2.gz WXRASTMGWBONIL-UHFFFAOYSA-N 1 1 395.326 3.049 10 0 GGAEMO O=C(N[C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]12)c1sc2c(c1Br)C[NH2+]C2 ZINC000662734466 567459750 /nfs/dbraw/zinc/45/97/50/567459750.db2.gz BBJFFAFIGIODCX-PSOPSSQASA-N 1 1 393.281 3.321 10 0 GGAEMO Cn1cc([C@H]2N(C(=O)c3sc4c(c3Br)C[NH2+]C4)CC2(C)C)cn1 ZINC000662759563 567460598 /nfs/dbraw/zinc/46/05/98/567460598.db2.gz UUKCQQVNUACDHR-CQSZACIVSA-N 1 1 395.326 3.071 10 0 GGAEMO CC1(C)CN(C(=O)c2sc3c(c2Br)C[NH2+]C3)[C@@H]1[C@@H]1CCCO1 ZINC000662757788 567460975 /nfs/dbraw/zinc/46/09/75/567460975.db2.gz IXIISWQSJBIPPA-IINYFYTJSA-N 1 1 385.327 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10 0 GGAEMO CCN(CC)[C@H](C[NH2+][C@H](C)Cn1cc(Br)ccc1=O)CC(C)C ZINC000550891520 567468188 /nfs/dbraw/zinc/46/81/88/567468188.db2.gz UDPHYEXPTPMFNQ-WBVHZDCISA-N 1 1 386.378 3.345 10 0 GGAEMO C[N@H+]1CC[C@H](NC(=O)c2cc(O)cc(Br)c2)[C@@H]1c1ccccc1 ZINC000528912358 567468577 /nfs/dbraw/zinc/46/85/77/567468577.db2.gz GCJUSKMEBSRSSN-IRXDYDNUSA-N 1 1 375.266 3.330 10 0 GGAEMO C[C@@H]1CN(C(=O)[C@@H]([NH3+])c2ccccc2Br)C[C@H](CC(F)(F)F)O1 ZINC000662971382 567470036 /nfs/dbraw/zinc/47/00/36/567470036.db2.gz SLHKSINGCYERBT-NRUUGDAUSA-N 1 1 395.219 3.017 10 0 GGAEMO C[N@H+](CCN1CCCS1(=O)=O)[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000663032625 567473567 /nfs/dbraw/zinc/47/35/67/567473567.db2.gz QUSRDZQJYYDCIE-LJQANCHMSA-N 1 1 378.925 3.397 10 0 GGAEMO C[N@@H+](CCN1CCCS1(=O)=O)[C@H](c1ccccc1)c1ccc(Cl)cc1 ZINC000663032625 567473569 /nfs/dbraw/zinc/47/35/69/567473569.db2.gz QUSRDZQJYYDCIE-LJQANCHMSA-N 1 1 378.925 3.397 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)N[C@@H](c1cncc(Br)c1)C1CC1 ZINC000551025579 567474113 /nfs/dbraw/zinc/47/41/13/567474113.db2.gz LODFUASTFJHHRW-CXAGYDPISA-N 1 1 395.345 3.469 10 0 GGAEMO CSc1c(C(=O)NC[C@@H](c2cccc(Cl)c2)[NH+]2CCCC2)cnn1C ZINC000478685989 567475249 /nfs/dbraw/zinc/47/52/49/567475249.db2.gz HRDNCRZVOFASCV-INIZCTEOSA-N 1 1 378.929 3.362 10 0 GGAEMO Brc1cc(C[N@@H+]2CCC[C@H](c3ccncn3)C2)cc2c1OCO2 ZINC000619725475 567475384 /nfs/dbraw/zinc/47/53/84/567475384.db2.gz QCCRTLYFQXRQSN-ZDUSSCGKSA-N 1 1 376.254 3.347 10 0 GGAEMO Brc1cc(C[N@H+]2CCC[C@H](c3ccncn3)C2)cc2c1OCO2 ZINC000619725475 567475391 /nfs/dbraw/zinc/47/53/91/567475391.db2.gz QCCRTLYFQXRQSN-ZDUSSCGKSA-N 1 1 376.254 3.347 10 0 GGAEMO CC(=O)NCC[N@@H+](Cc1ccc(Br)s1)C[C@H]1CCO[C@@H](C)C1 ZINC000503248353 567476498 /nfs/dbraw/zinc/47/64/98/567476498.db2.gz YVQDEJLTEJPFNW-JSGCOSHPSA-N 1 1 389.359 3.264 10 0 GGAEMO C[N@@H+]1CCN(C(=O)c2cc(Br)cc3[nH]cnc32)c2ccccc2C1 ZINC000503325175 567479933 /nfs/dbraw/zinc/47/99/33/567479933.db2.gz SGAKMJULACQDBO-UHFFFAOYSA-N 1 1 385.265 3.418 10 0 GGAEMO C[N@H+]1CCN(C(=O)c2cc(Br)cc3[nH]cnc32)c2ccccc2C1 ZINC000503325175 567479938 /nfs/dbraw/zinc/47/99/38/567479938.db2.gz SGAKMJULACQDBO-UHFFFAOYSA-N 1 1 385.265 3.418 10 0 GGAEMO C[N@@H+]1CCN(C(=O)c2cc(Br)cc3nc[nH]c32)c2ccccc2C1 ZINC000503325175 567479940 /nfs/dbraw/zinc/47/99/40/567479940.db2.gz SGAKMJULACQDBO-UHFFFAOYSA-N 1 1 385.265 3.418 10 0 GGAEMO C[N@H+]1CCN(C(=O)c2cc(Br)cc3nc[nH]c32)c2ccccc2C1 ZINC000503325175 567479943 /nfs/dbraw/zinc/47/99/43/567479943.db2.gz SGAKMJULACQDBO-UHFFFAOYSA-N 1 1 385.265 3.418 10 0 GGAEMO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503293127 567480160 /nfs/dbraw/zinc/48/01/60/567480160.db2.gz SGWDUFSTYDBPHD-VXGBXAGGSA-N 1 1 379.302 3.318 10 0 GGAEMO CCOc1c(Br)cc(Cl)cc1NC(=O)N1CC[NH+](C)CC1 ZINC000642478940 567481220 /nfs/dbraw/zinc/48/12/20/567481220.db2.gz QUXLOKIIKCPFKG-UHFFFAOYSA-N 1 1 376.682 3.281 10 0 GGAEMO CC[N@H+]1CCC[C@@H](CNC(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000503452456 567486195 /nfs/dbraw/zinc/48/61/95/567486195.db2.gz CFLAGKBYQRENNF-NSHDSACASA-N 1 1 375.257 3.118 10 0 GGAEMO CCC[N@H+]1CC[C@H](NC(=O)c2c(F)c(F)c(Br)c(F)c2F)C1 ZINC000619903636 567486323 /nfs/dbraw/zinc/48/63/23/567486323.db2.gz BGCZFLJCRNILFP-ZETCQYMHSA-N 1 1 383.183 3.220 10 0 GGAEMO Cc1ncc(C[NH2+][C@H]2CCCN(c3ccc(Br)c(C)c3)C2=O)o1 ZINC000642716221 567487213 /nfs/dbraw/zinc/48/72/13/567487213.db2.gz XPYMYMJBNOWYTR-INIZCTEOSA-N 1 1 378.270 3.339 10 0 GGAEMO Cc1cc(C(=O)N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c(Br)s1 ZINC000619971165 567487705 /nfs/dbraw/zinc/48/77/05/567487705.db2.gz KGGWWSJZIAWJDM-ZIAGYGMSSA-N 1 1 399.354 3.192 10 0 GGAEMO Cc1cccc(C(=O)N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c1Br ZINC000619969567 567488042 /nfs/dbraw/zinc/48/80/42/567488042.db2.gz RRTTWCPVQNRGMM-HZPDHXFCSA-N 1 1 393.325 3.131 10 0 GGAEMO C[C@@H](CC(=O)N(C)c1ccccc1)[NH2+][C@@H](C)c1ncc(Br)cn1 ZINC000551210028 567488184 /nfs/dbraw/zinc/48/81/84/567488184.db2.gz RLSILJIRZVECDO-STQMWFEESA-N 1 1 377.286 3.331 10 0 GGAEMO Cc1cccc(Br)c1C(=O)N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000619967724 567488596 /nfs/dbraw/zinc/48/85/96/567488596.db2.gz UHJIJPUQACWMMD-HZPDHXFCSA-N 1 1 393.325 3.131 10 0 GGAEMO O=C(CSc1ccccc1Cl)N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000619972866 567488929 /nfs/dbraw/zinc/48/89/29/567488929.db2.gz KQKURPWYEISLMW-IAGOWNOFSA-N 1 1 380.941 3.192 10 0 GGAEMO O=C(Cc1c(Cl)cccc1Cl)N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000619974477 567489541 /nfs/dbraw/zinc/48/95/41/567489541.db2.gz KDFNBCVMLJPDIA-IAGOWNOFSA-N 1 1 383.319 3.296 10 0 GGAEMO COC(=O)c1cc(C[NH2+]Cc2cc(OC)c(O)cc2Br)c(C)o1 ZINC000594607642 567490193 /nfs/dbraw/zinc/49/01/93/567490193.db2.gz ZHCYWRWCBHAJSU-UHFFFAOYSA-N 1 1 384.226 3.141 10 0 GGAEMO COCc1cnc(C[N@@H+]2C[C@H](C(=O)OC)[C@@H](c3ccc(Cl)cc3)C2)s1 ZINC000594608962 567490457 /nfs/dbraw/zinc/49/04/57/567490457.db2.gz JFIUVALQVDELDP-CVEARBPZSA-N 1 1 380.897 3.332 10 0 GGAEMO COCc1cnc(C[N@H+]2C[C@H](C(=O)OC)[C@@H](c3ccc(Cl)cc3)C2)s1 ZINC000594608962 567490459 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Cc1nc(-c2ccc(CNC(=O)N[C@@H]3CC[N@@H+](CC4CC4)C3)s2)cs1 ZINC000594955300 567529524 /nfs/dbraw/zinc/52/95/24/567529524.db2.gz RLUXYKRQHXJKJQ-CQSZACIVSA-N 1 1 376.551 3.464 10 0 GGAEMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1c2ccc(Br)cc2nn1C ZINC000620620443 567531117 /nfs/dbraw/zinc/53/11/17/567531117.db2.gz HFIJVBLDAFYHTF-UHFFFAOYSA-N 1 1 381.318 3.186 10 0 GGAEMO CCNC(=O)C[C@H]1CCCC[N@H+]1CCC(=O)Nc1cccc(Br)c1 ZINC000551723243 567531936 /nfs/dbraw/zinc/53/19/36/567531936.db2.gz YPSNOQZDDKXKLL-MRXNPFEDSA-N 1 1 396.329 3.158 10 0 GGAEMO Clc1ccc(Br)c2ccc(N3CC[N@@H+]4CCOC[C@@H]4C3)nc12 ZINC000571055566 567532857 /nfs/dbraw/zinc/53/28/57/567532857.db2.gz JTANIZMXVWOLLG-NSHDSACASA-N 1 1 382.689 3.172 10 0 GGAEMO Clc1ccc(Br)c2ccc(N3CC[N@H+]4CCOC[C@@H]4C3)nc12 ZINC000571055566 567532863 /nfs/dbraw/zinc/53/28/63/567532863.db2.gz JTANIZMXVWOLLG-NSHDSACASA-N 1 1 382.689 3.172 10 0 GGAEMO O=C(Nc1nncs1)C1CC[NH+](Cc2ccsc2Br)CC1 ZINC000529565420 567532747 /nfs/dbraw/zinc/53/27/47/567532747.db2.gz 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ZINC000103173667 1410834137 /nfs/dbraw/zinc/83/41/37/1410834137.db2.gz BFEUZOCHVTYXRM-HXUWFJFHSA-N 1 1 375.520 3.136 10 0 GGAEMO Cn1cc(CNC[C@H]2CC[N@@H+](CCc3ccccc3)C2)c(-c2ccncc2)n1 ZINC000103173667 1410834138 /nfs/dbraw/zinc/83/41/38/1410834138.db2.gz BFEUZOCHVTYXRM-HXUWFJFHSA-N 1 1 375.520 3.136 10 0 GGAEMO COC(=O)c1cc(F)ccc1C[NH+]1CCC(C(=O)N2CCCCCC2)CC1 ZINC000103465489 1410860655 /nfs/dbraw/zinc/86/06/55/1410860655.db2.gz TWGUHZCGXJGVBT-UHFFFAOYSA-N 1 1 376.472 3.227 10 0 GGAEMO C[C@H](CNC(=O)COC(c1ccccc1)c1ccccc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000106056165 1411160736 /nfs/dbraw/zinc/16/07/36/1411160736.db2.gz PJLDMFXHPJEOSY-AQNXPRMDSA-N 1 1 396.531 3.407 10 0 GGAEMO C[C@H](CNC(=O)COC(c1ccccc1)c1ccccc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000106056165 1411160755 /nfs/dbraw/zinc/16/07/55/1411160755.db2.gz PJLDMFXHPJEOSY-AQNXPRMDSA-N 1 1 396.531 3.407 10 0 GGAEMO Cc1ccc(-c2noc([C@@H](C)[N@@H+]3CCCN(c4cccnn4)CC3)n2)cc1F ZINC000106071598 1411165032 /nfs/dbraw/zinc/16/50/32/1411165032.db2.gz LIHAFWWCZQYEPD-OAHLLOKOSA-N 1 1 382.443 3.247 10 0 GGAEMO Cc1ccc(-c2noc([C@@H](C)[N@H+]3CCCN(c4cccnn4)CC3)n2)cc1F ZINC000106071598 1411165045 /nfs/dbraw/zinc/16/50/45/1411165045.db2.gz LIHAFWWCZQYEPD-OAHLLOKOSA-N 1 1 382.443 3.247 10 0 GGAEMO CC(C)COc1ccc(C[NH2+]Cc2ccccc2S(=O)(=O)N(C)C)cc1 ZINC000106466595 1411222674 /nfs/dbraw/zinc/22/26/74/1411222674.db2.gz BEOIOWAXUAQMPL-UHFFFAOYSA-N 1 1 376.522 3.262 10 0 GGAEMO CC[NH+]1CCN(CCCCNC(=O)[C@@H]2C[C@@H]2c2cccc3ccccc32)CC1 ZINC000107780402 1411410520 /nfs/dbraw/zinc/41/05/20/1411410520.db2.gz FYXNDSNHYPRUNS-DHIUTWEWSA-N 1 1 379.548 3.477 10 0 GGAEMO CC[NH+]1CCN(CCCCNC(=O)[C@H]2C[C@H]2c2cccc3ccccc32)CC1 ZINC000107780413 1411411018 /nfs/dbraw/zinc/41/10/18/1411411018.db2.gz FYXNDSNHYPRUNS-GOTSBHOMSA-N 1 1 379.548 3.477 10 0 GGAEMO Cc1cc(C)cc(NC(=O)C[N@H+](Cc2ccccc2)[C@@H](C)CN2CCOCC2)c1 ZINC000111055032 1411884616 /nfs/dbraw/zinc/88/46/16/1411884616.db2.gz AXMLDCYDIQXRMD-NRFANRHFSA-N 1 1 395.547 3.465 10 0 GGAEMO Cc1cc(C)cc(NC(=O)C[N@@H+](Cc2ccccc2)[C@@H](C)CN2CCOCC2)c1 ZINC000111055032 1411884619 /nfs/dbraw/zinc/88/46/19/1411884619.db2.gz AXMLDCYDIQXRMD-NRFANRHFSA-N 1 1 395.547 3.465 10 0 GGAEMO C[C@H](O)C1CC[NH+](CC(=O)Nc2cc(C(C)(C)C)nn2-c2ccccc2)CC1 ZINC000111286510 1411899735 /nfs/dbraw/zinc/89/97/35/1411899735.db2.gz AVAXXQOWASRFOW-INIZCTEOSA-N 1 1 384.524 3.201 10 0 GGAEMO O=C(C[NH2+]Cc1ccccc1OCc1ccccn1)NCCc1ccccc1 ZINC000111400531 1411944691 /nfs/dbraw/zinc/94/46/91/1411944691.db2.gz HMCGMGAUTYYSHU-UHFFFAOYSA-N 1 1 375.472 3.109 10 0 GGAEMO CCc1nc(C[NH+]2CCC(CNC(=O)NCCc3ccccc3)CC2)cs1 ZINC000111423611 1411950972 /nfs/dbraw/zinc/95/09/72/1411950972.db2.gz FKSSLJKWKQCULP-UHFFFAOYSA-N 1 1 386.565 3.459 10 0 GGAEMO O=C(NCCC[NH+]1CCOCC1)[C@@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1 ZINC000112040036 1412070836 /nfs/dbraw/zinc/07/08/36/1412070836.db2.gz AJLBTTCSYYGXIG-DHIUTWEWSA-N 1 1 394.515 3.208 10 0 GGAEMO O=C(NCCC[NH+]1CCOCC1)[C@H]1C[C@@H]1c1ccc(OCc2ccccc2)cc1 ZINC000112040033 1412070968 /nfs/dbraw/zinc/07/09/68/1412070968.db2.gz AJLBTTCSYYGXIG-PKTZIBPZSA-N 1 1 394.515 3.208 10 0 GGAEMO C[NH+](C)CCN1CCC(CNC(=O)[C@H]2C[C@H]2c2cccc3ccccc32)CC1 ZINC000114381691 1412423855 /nfs/dbraw/zinc/42/38/55/1412423855.db2.gz FARBLNPGWROQJH-GOTSBHOMSA-N 1 1 379.548 3.333 10 0 GGAEMO C[NH+](C)CCN1CCC(CNC(=O)[C@H]2C[C@@H]2c2cccc3ccccc32)CC1 ZINC000114381687 1412424181 /nfs/dbraw/zinc/42/41/81/1412424181.db2.gz FARBLNPGWROQJH-PKTZIBPZSA-N 1 1 379.548 3.333 10 0 GGAEMO C[C@H](c1nnc(-c2cccc(Cl)c2)o1)N1CCC([N@@H+](C)CCCO)CC1 ZINC000115548579 1412705114 /nfs/dbraw/zinc/70/51/14/1412705114.db2.gz GVIKQRWDYXHLQK-CQSZACIVSA-N 1 1 378.904 3.230 10 0 GGAEMO Cn1nc(-c2ccccc2)c(C[NH2+]Cc2cccnc2N2CCOCC2)c1Cl ZINC000116334331 1412850832 /nfs/dbraw/zinc/85/08/32/1412850832.db2.gz DHQPKAJYSLMTSC-UHFFFAOYSA-N 1 1 397.910 3.262 10 0 GGAEMO CCN(C(C)=O)c1nc(C[NH2+][C@@H]2CCCN(c3cccc(F)c3)C2)cs1 ZINC000116375283 1412853406 /nfs/dbraw/zinc/85/34/06/1412853406.db2.gz BEZTVPWAKCSFBC-MRXNPFEDSA-N 1 1 376.501 3.414 10 0 GGAEMO Cc1cccc(N2CCC(NC(=O)C(C)(C)c3ccc4c(c3)OCCO4)CC2)[nH+]1 ZINC000116669259 1412894914 /nfs/dbraw/zinc/89/49/14/1412894914.db2.gz OCZUMPHXVJODFQ-UHFFFAOYSA-N 1 1 395.503 3.224 10 0 GGAEMO COC(=O)c1ccc(NC(=O)N2CC[NH+](Cc3ccccc3)CC2)cc1Cl ZINC000118561611 1413180835 /nfs/dbraw/zinc/18/08/35/1413180835.db2.gz GCXNXTXMKRBGRO-UHFFFAOYSA-N 1 1 387.867 3.476 10 0 GGAEMO c1nn(Cc2ccccc2)cc1CNc1ncnc2c1cnn2-c1cc[nH+]cc1 ZINC000119000968 1413299533 /nfs/dbraw/zinc/29/95/33/1413299533.db2.gz BTLXGLGCNNADGR-UHFFFAOYSA-N 1 1 382.431 3.067 10 0 GGAEMO COc1cc(C[N@@H+](C)[C@H](C)c2ccccc2)ccc1OCC(=O)N1CCOCC1 ZINC000119378019 1413429700 /nfs/dbraw/zinc/42/97/00/1413429700.db2.gz CUJNVZPNGROWJC-GOSISDBHSA-N 1 1 398.503 3.126 10 0 GGAEMO CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000119421057 1413441701 /nfs/dbraw/zinc/44/17/01/1413441701.db2.gz FXZSJOHDYZWMJE-BHIYHBOVSA-N 1 1 393.572 3.401 10 0 GGAEMO C[C@@H]1CN(Cc2ccc(C[NH2+]Cc3ccc4c(c3)OCCO4)cc2)C[C@@H](C)O1 ZINC000119683093 1413530192 /nfs/dbraw/zinc/53/01/92/1413530192.db2.gz CJPADUVPXZIXRT-QZTJIDSGSA-N 1 1 382.504 3.357 10 0 GGAEMO NC(=O)[C@@H]1CCC[N@H+]1Cc1cccc(NCc2c(F)cccc2N2CCCC2)c1 ZINC000120069859 1413675413 /nfs/dbraw/zinc/67/54/13/1413675413.db2.gz FOUQMKDMGRJWQL-QFIPXVFZSA-N 1 1 396.510 3.488 10 0 GGAEMO Cc1ccc(-c2n[nH]cc2CNc2cccc(C[N@H+]3CCC[C@H]3C(N)=O)c2)cc1 ZINC000120122931 1413696244 /nfs/dbraw/zinc/69/62/44/1413696244.db2.gz FZLBUIUALDYHTQ-NRFANRHFSA-N 1 1 389.503 3.447 10 0 GGAEMO CN(CC1CC[NH+](C[C@H](O)c2ccccc2)CC1)C(=O)c1[nH]nc2ccccc21 ZINC000177470114 1428752702 /nfs/dbraw/zinc/75/27/02/1428752702.db2.gz UKXPRBYTGPUYQB-NRFANRHFSA-N 1 1 392.503 3.081 10 0 GGAEMO C[C@@H]1C[C@H](NC(=O)NCc2ccc(OCc3ccccn3)cc2)C[N@H+]1C1CC1 ZINC000120296481 1413772412 /nfs/dbraw/zinc/77/24/12/1413772412.db2.gz DSSKABWTNMRBGD-APWZRJJASA-N 1 1 380.492 3.085 10 0 GGAEMO NC(=O)c1ccc(CNC(=O)C[NH+](Cc2ccccc2)Cc2ccccc2)cc1 ZINC000120461152 1413823179 /nfs/dbraw/zinc/82/31/79/1413823179.db2.gz OEHSQISQQMHUMN-UHFFFAOYSA-N 1 1 387.483 3.104 10 0 GGAEMO c1ccc(CCN2CCC([NH2+]C[C@@H](c3ccccc3)N3CCOCC3)CC2)cc1 ZINC000120623419 1413858237 /nfs/dbraw/zinc/85/82/37/1413858237.db2.gz FEYABVYXBYMTRV-VWLOTQADSA-N 1 1 393.575 3.357 10 0 GGAEMO CC(C)(C)[C@@H]([NH2+]Cc1cccc(OC(F)F)c1)c1nc(-c2nc[nH]n2)no1 ZINC000120949660 1413957335 /nfs/dbraw/zinc/95/73/35/1413957335.db2.gz CMINDKGQNXFERD-LBPRGKRZSA-N 1 1 378.383 3.333 10 0 GGAEMO COc1ccc(C[N@H+]2CC[C@@H](N3CCOCC3)C2)cc1OCc1ccccc1 ZINC000120950551 1413957448 /nfs/dbraw/zinc/95/74/48/1413957448.db2.gz FBKBCXQHRZTRQT-OAQYLSRUSA-N 1 1 382.504 3.181 10 0 GGAEMO C[C@@H](Cc1ccc(Cl)cc1)[N@H+](C)Cc1nnc2n1c1ccccc1c(=O)n2C ZINC000121020973 1413978980 /nfs/dbraw/zinc/97/89/80/1413978980.db2.gz BNDXBXQCVAPYSO-AWEZNQCLSA-N 1 1 395.894 3.298 10 0 GGAEMO C[C@@H](Cc1ccc(Cl)cc1)[N@@H+](C)Cc1nnc2n1c1ccccc1c(=O)n2C ZINC000121020973 1413978985 /nfs/dbraw/zinc/97/89/85/1413978985.db2.gz BNDXBXQCVAPYSO-AWEZNQCLSA-N 1 1 395.894 3.298 10 0 GGAEMO C[C@H](NC(=O)N1CC[NH+](Cc2ccccc2)CC1)c1noc(-c2ccccc2)n1 ZINC000121523066 1414161638 /nfs/dbraw/zinc/16/16/38/1414161638.db2.gz HXHZKVRDYXNYMI-KRWDZBQOSA-N 1 1 391.475 3.325 10 0 GGAEMO O=C(Nc1cccc(C[NH2+]Cc2c(Cl)nc3ccccn32)c1)[C@@H]1CCCO1 ZINC000121669974 1414218059 /nfs/dbraw/zinc/21/80/59/1414218059.db2.gz CDSYDYUEEGGWCD-KRWDZBQOSA-N 1 1 384.867 3.395 10 0 GGAEMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1cc(NC(C)=O)ccc1O ZINC000122966597 1414608870 /nfs/dbraw/zinc/60/88/70/1414608870.db2.gz FGNUDKIPEDUEEZ-LJQANCHMSA-N 1 1 395.503 3.335 10 0 GGAEMO Cc1cc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ncccn2)cc(C)c1OCC(F)(F)F ZINC000123077102 1414635169 /nfs/dbraw/zinc/63/51/69/1414635169.db2.gz DVPOCVPVYKLAPJ-AWEZNQCLSA-N 1 1 396.413 3.494 10 0 GGAEMO Cc1cc(C[N@H+](C)[C@@H](C)C(=O)Nc2ncccn2)cc(C)c1OCC(F)(F)F ZINC000123077102 1414635172 /nfs/dbraw/zinc/63/51/72/1414635172.db2.gz DVPOCVPVYKLAPJ-AWEZNQCLSA-N 1 1 396.413 3.494 10 0 GGAEMO Cc1nn(-c2ccc(Br)cc2)cc1C[NH2+]C[C@@H](C1CC1)N(C)C ZINC000123477757 1414745707 /nfs/dbraw/zinc/74/57/07/1414745707.db2.gz GMNZARUAPCDQPY-SFHVURJKSA-N 1 1 377.330 3.373 10 0 GGAEMO COC(=O)c1ccc(C)c(NC(=O)[C@@H](C)N2CCC(CCC[NH+](C)C)CC2)c1 ZINC000123553408 1414771770 /nfs/dbraw/zinc/77/17/70/1414771770.db2.gz BDFZMCHJGHFAEH-QGZVFWFLSA-N 1 1 389.540 3.162 10 0 GGAEMO COc1ccc(NC(=O)N2CC[N@H+](Cc3ccccc3)C[C@H]2C)cc1NC(C)=O ZINC000177730826 1428843748 /nfs/dbraw/zinc/84/37/48/1428843748.db2.gz FEBFAUMMRVQOLC-MRXNPFEDSA-N 1 1 396.491 3.392 10 0 GGAEMO COc1ccc(NC(=O)N2CC[N@@H+](Cc3ccccc3)C[C@H]2C)cc1NC(C)=O ZINC000177730826 1428843752 /nfs/dbraw/zinc/84/37/52/1428843752.db2.gz FEBFAUMMRVQOLC-MRXNPFEDSA-N 1 1 396.491 3.392 10 0 GGAEMO COc1ccc(NC(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1NC(C)=O ZINC000177730844 1428844453 /nfs/dbraw/zinc/84/44/53/1428844453.db2.gz FEBFAUMMRVQOLC-INIZCTEOSA-N 1 1 396.491 3.392 10 0 GGAEMO COc1ccc(NC(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cc1NC(C)=O ZINC000177730844 1428844460 /nfs/dbraw/zinc/84/44/60/1428844460.db2.gz FEBFAUMMRVQOLC-INIZCTEOSA-N 1 1 396.491 3.392 10 0 GGAEMO CC(C)c1[nH+]ccn1Cc1cccc(NC(=O)C(=O)NCCc2ccccc2)c1 ZINC000124265799 1414924511 /nfs/dbraw/zinc/92/45/11/1414924511.db2.gz GABBXPTZYKUGAY-UHFFFAOYSA-N 1 1 390.487 3.352 10 0 GGAEMO C[C@@H](Nc1ccc([NH+]2CCC(C)CC2)cc1)C(=O)NC(=O)NCC(F)(F)F ZINC000124782631 1415043375 /nfs/dbraw/zinc/04/33/75/1415043375.db2.gz HMRQLVBAULKKJT-CYBMUJFWSA-N 1 1 386.418 3.111 10 0 GGAEMO C[C@@H](C(=O)Nc1ccccc1Cc1ccccc1)[NH+]1CCC(CC(N)=O)CC1 ZINC000124896880 1415068707 /nfs/dbraw/zinc/06/87/07/1415068707.db2.gz BNVDWPWABKZDDL-KRWDZBQOSA-N 1 1 379.504 3.192 10 0 GGAEMO C[C@H](C(=O)Nc1ccccc1Cc1ccccc1)[NH+]1CCC(CC(N)=O)CC1 ZINC000124897154 1415068800 /nfs/dbraw/zinc/06/88/00/1415068800.db2.gz BNVDWPWABKZDDL-QGZVFWFLSA-N 1 1 379.504 3.192 10 0 GGAEMO COc1cccc(CNC(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1OC ZINC000125257824 1415144109 /nfs/dbraw/zinc/14/41/09/1415144109.db2.gz BAEISXFUKKHEQX-KRWDZBQOSA-N 1 1 383.492 3.120 10 0 GGAEMO COc1cccc(CNC(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1OC ZINC000125257824 1415144122 /nfs/dbraw/zinc/14/41/22/1415144122.db2.gz BAEISXFUKKHEQX-KRWDZBQOSA-N 1 1 383.492 3.120 10 0 GGAEMO CC(=O)Nc1cccc(CNC(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000125294834 1415155742 /nfs/dbraw/zinc/15/57/42/1415155742.db2.gz CDTNANOWOFLIOT-KRWDZBQOSA-N 1 1 380.492 3.061 10 0 GGAEMO CC(=O)Nc1cccc(CNC(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000125294834 1415155750 /nfs/dbraw/zinc/15/57/50/1415155750.db2.gz CDTNANOWOFLIOT-KRWDZBQOSA-N 1 1 380.492 3.061 10 0 GGAEMO C[C@H](Nc1ccc([NH+]2CCCCC2)cc1)C(=O)NC[C@@H]1COc2ccccc2O1 ZINC000126490845 1415468711 /nfs/dbraw/zinc/46/87/11/1415468711.db2.gz BOSOKVKZGFQQSS-FXAWDEMLSA-N 1 1 395.503 3.434 10 0 GGAEMO CC(C)(C)OC(=O)N1CCc2cccc(C[NH+]3CCN(c4cccnn4)CC3)c21 ZINC000127965662 1415884777 /nfs/dbraw/zinc/88/47/77/1415884777.db2.gz XMIIEVARKSJTPD-UHFFFAOYSA-N 1 1 395.507 3.096 10 0 GGAEMO Cc1nn(C)c(OCC(F)(F)F)c1C[NH2+]Cc1cccc2c1OCCCO2 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375.847 3.008 10 0 GGAEMO Cc1ccc(I)c(C(=O)N2CCC[C@H]3C[N@@H+](C)CC[C@H]32)c1 ZINC000119253575 564261792 /nfs/dbraw/zinc/26/17/92/564261792.db2.gz FJARZDFSIGWKCV-XJKSGUPXSA-N 1 1 398.288 3.156 10 0 GGAEMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3c(cccc3Br)[nH]2)C1 ZINC000119350533 564266720 /nfs/dbraw/zinc/26/67/20/564266720.db2.gz KJBOTLCCLFNSLO-SJKOYZFVSA-N 1 1 376.298 3.487 10 0 GGAEMO O=C1[C@H]([NH2+]Cc2cc(C(F)(F)F)ccc2Cl)CCN1C1CCOCC1 ZINC000119454906 564271932 /nfs/dbraw/zinc/27/19/32/564271932.db2.gz GIOSHKPIKBGGRG-OAHLLOKOSA-N 1 1 376.806 3.228 10 0 GGAEMO COc1ccc(C(=O)[C@H]2CCC[N@H+](C3CSCCSC3)C2)cc1OC ZINC000013594046 564277482 /nfs/dbraw/zinc/27/74/82/564277482.db2.gz BILTUKQTNXCODY-HNNXBMFYSA-N 1 1 381.563 3.447 10 0 GGAEMO Cc1ccc(N2CCC(NC(=O)Nc3cccnc3Br)CC2)[nH+]c1 ZINC000119579069 564277489 /nfs/dbraw/zinc/27/74/89/564277489.db2.gz QFGMZEVNMNHJHV-UHFFFAOYSA-N 1 1 390.285 3.338 10 0 GGAEMO Cc1[nH+]ccn1CCCN(C)C(=O)NCc1cc(F)cc(Br)c1 ZINC000120022301 564301050 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C[C@@H](O)[C@@H]1CCC[N@@H+](CCCOc2cccc(I)c2)C1 ZINC000120837650 564339725 /nfs/dbraw/zinc/33/97/25/564339725.db2.gz FDFJVEAYQIUZOA-ZIAGYGMSSA-N 1 1 389.277 3.153 10 0 GGAEMO C[C@@H](O)[C@H]1CCC[N@@H+](CCCOc2cccc(I)c2)C1 ZINC000120837965 564340004 /nfs/dbraw/zinc/34/00/04/564340004.db2.gz FDFJVEAYQIUZOA-KGLIPLIRSA-N 1 1 389.277 3.153 10 0 GGAEMO CC[C@H]1CN(CC2=Cc3cc(Br)ccc3OC2)CC[N@H+]1CCOC ZINC000120957088 564345126 /nfs/dbraw/zinc/34/51/26/564345126.db2.gz XWSRXAMKLRYTDQ-SFHVURJKSA-N 1 1 395.341 3.268 10 0 GGAEMO CC[C@@H]1CN(CC2=Cc3cc(Br)ccc3OC2)CC[N@H+]1CCOC ZINC000120956930 564345384 /nfs/dbraw/zinc/34/53/84/564345384.db2.gz XWSRXAMKLRYTDQ-GOSISDBHSA-N 1 1 395.341 3.268 10 0 GGAEMO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc(C(N)=O)cc1)c1ccccc1Br ZINC000120959919 564345427 /nfs/dbraw/zinc/34/54/27/564345427.db2.gz MENSPHIBBCNEQQ-NEPJUHHUSA-N 1 1 390.281 3.226 10 0 GGAEMO C[C@@H]([NH2+][C@H](C)c1ccccc1Br)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000120960182 564346273 /nfs/dbraw/zinc/34/62/73/564346273.db2.gz MENSPHIBBCNEQQ-VXGBXAGGSA-N 1 1 390.281 3.226 10 0 GGAEMO C[C@@H]([NH2+][C@@H](C)c1ccccc1Br)C(=O)Nc1ccc(C(N)=O)cc1 ZINC000120960048 564346283 /nfs/dbraw/zinc/34/62/83/564346283.db2.gz MENSPHIBBCNEQQ-NWDGAFQWSA-N 1 1 390.281 3.226 10 0 GGAEMO O[C@@H](C[N@H+]1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1)C(F)(F)F ZINC000121578617 564375609 /nfs/dbraw/zinc/37/56/09/564375609.db2.gz FHRZRRFTKTYTTE-AAEUAGOBSA-N 1 1 375.778 3.493 10 0 GGAEMO COc1cc(Cl)c(CN2CCC[N@@H+](Cc3cnn(C)c3)CC2)cc1Cl ZINC000121605330 564377819 /nfs/dbraw/zinc/37/78/19/564377819.db2.gz GQDMPHIKUDOOJP-UHFFFAOYSA-N 1 1 383.323 3.443 10 0 GGAEMO CC[NH+](CC)[C@H](CNS(=O)(=O)c1cccc2nsnc21)c1ccsc1 ZINC000030435667 564380586 /nfs/dbraw/zinc/38/05/86/564380586.db2.gz FVRIEIYPZGPIEI-CQSZACIVSA-N 1 1 396.563 3.114 10 0 GGAEMO C[NH+](C)C[C@@H](NS(=O)(=O)c1cccc(Br)c1)c1ccccc1 ZINC000030499509 564381390 /nfs/dbraw/zinc/38/13/90/564381390.db2.gz KUTVKWKFAYQBJK-MRXNPFEDSA-N 1 1 383.311 3.030 10 0 GGAEMO 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COCC[N@@H+](Cc1ccc(Cl)cc1)Cc1cc(=O)n2cc(C)sc2n1 ZINC000033068924 564409395 /nfs/dbraw/zinc/40/93/95/564409395.db2.gz HXJPETVRPLKHSO-UHFFFAOYSA-N 1 1 377.897 3.366 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)C(=O)COc2ccc(Br)cc2F)[C@H](C)C1 ZINC000122360455 564410740 /nfs/dbraw/zinc/41/07/40/564410740.db2.gz ROGFAQZLOXVQMI-DOMZBBRYSA-N 1 1 387.293 3.156 10 0 GGAEMO C[C@H](CNc1ncnc2cccc(I)c21)[N@@H+](C)C1CC1 ZINC000545166368 564411208 /nfs/dbraw/zinc/41/12/08/564411208.db2.gz VGCIMRNIPQYSLH-SNVBAGLBSA-N 1 1 382.249 3.129 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cccc(I)c2)[C@H](C)C1 ZINC000122509456 564416298 /nfs/dbraw/zinc/41/62/98/564416298.db2.gz ONYOKVTWDVXVDB-DOMZBBRYSA-N 1 1 386.277 3.094 10 0 GGAEMO C[C@H](CC(=O)N1C[C@H](C)[C@H]([NH+]2CCOCC2)C1)c1ccc(Br)cc1 ZINC000122755646 564426153 /nfs/dbraw/zinc/42/61/53/564426153.db2.gz SHCKSIGLWOWLIL-RVKKMQEKSA-N 1 1 395.341 3.122 10 0 GGAEMO COc1ccc(CCC(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1Br ZINC000122792510 564427710 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CCCNC(=O)C[NH2+][C@@H](C)c1ccc(Br)cc1Br ZINC000041641956 564435918 /nfs/dbraw/zinc/43/59/18/564435918.db2.gz XDPQLLIXEHSCOP-VIFPVBQESA-N 1 1 378.108 3.388 10 0 GGAEMO Cc1cccc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c1I ZINC000123056296 564437644 /nfs/dbraw/zinc/43/76/44/564437644.db2.gz MUNDJIDMKXAXAR-OLZOCXBDSA-N 1 1 386.277 3.154 10 0 GGAEMO C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)N1CC[NH+](C2CC2)CC1 ZINC000123154101 564440198 /nfs/dbraw/zinc/44/01/98/564440198.db2.gz BXDIPTOTFUKCDX-GFCCVEGCSA-N 1 1 384.293 3.009 10 0 GGAEMO COC(=O)[C@@H]1CCC[N@H+](Cc2nc(-c3cccc(Br)c3)c[nH]2)C1 ZINC000123190604 564441501 /nfs/dbraw/zinc/44/15/01/564441501.db2.gz RZRMOOPDFJEHBI-CYBMUJFWSA-N 1 1 378.270 3.224 10 0 GGAEMO COC(=O)[C@@H]1CCC[N@@H+](Cc2nc(-c3cccc(Br)c3)c[nH]2)C1 ZINC000123190604 564441505 /nfs/dbraw/zinc/44/15/05/564441505.db2.gz RZRMOOPDFJEHBI-CYBMUJFWSA-N 1 1 378.270 3.224 10 0 GGAEMO C[C@H]1C[C@H](N(C)Cc2nc(-c3cccc(Br)c3)no2)CC[N@H+]1C ZINC000123224718 564443202 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10 0 GGAEMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3cc4c(cccc4Br)[nH]3)CC[C@@H]21 ZINC000155774407 565071446 /nfs/dbraw/zinc/07/14/46/565071446.db2.gz PDIACVANZLCOEB-PXAZEXFGSA-N 1 1 376.298 3.487 10 0 GGAEMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1ccc(Sc2ccccc2Cl)nn1 ZINC000155795550 565071821 /nfs/dbraw/zinc/07/18/21/565071821.db2.gz SNLLLZUDOJALSL-CHWSQXEVSA-N 1 1 376.913 3.446 10 0 GGAEMO O[C@H](CNCc1ccc(Br)c(F)c1)C[N@@H+]1CCc2ccccc2C1 ZINC000155822538 565071882 /nfs/dbraw/zinc/07/18/82/565071882.db2.gz YPNMTGJXVKTMFH-QGZVFWFLSA-N 1 1 393.300 3.097 10 0 GGAEMO O[C@H](CNCc1ccc(Br)c(F)c1)C[N@H+]1CCc2ccccc2C1 ZINC000155822538 565071883 /nfs/dbraw/zinc/07/18/83/565071883.db2.gz YPNMTGJXVKTMFH-QGZVFWFLSA-N 1 1 393.300 3.097 10 0 GGAEMO O=C(CC[N@@H+]1CCC[C@@H]1C(=O)Nc1nccs1)Nc1cccc(Cl)c1 ZINC000114194955 565072733 /nfs/dbraw/zinc/07/27/33/565072733.db2.gz ZFLCQFRJEKYRQP-CQSZACIVSA-N 1 1 378.885 3.228 10 0 GGAEMO O=C(CC[N@H+]1CCC[C@@H]1C(=O)Nc1nccs1)Nc1cccc(Cl)c1 ZINC000114194955 565072734 /nfs/dbraw/zinc/07/27/34/565072734.db2.gz ZFLCQFRJEKYRQP-CQSZACIVSA-N 1 1 378.885 3.228 10 0 GGAEMO C[N@@H+](C[C@H](O)COc1ccc(Cl)cc1Br)CC1CCOCC1 ZINC000155985347 565073404 /nfs/dbraw/zinc/07/34/04/565073404.db2.gz DUAPFACJHINVEH-AWEZNQCLSA-N 1 1 392.721 3.201 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)C(=O)Cc2c[nH]c3cccc(Br)c23)CC[N@H+]1C ZINC000155994343 565073690 /nfs/dbraw/zinc/07/36/90/565073690.db2.gz QXOMTPKKFHNTOT-OCCSQVGLSA-N 1 1 378.314 3.414 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(C(=O)C2(c3cncc(Br)c3)CC2)CC1 ZINC000369196363 565080801 /nfs/dbraw/zinc/08/08/01/565080801.db2.gz FJTSUSXEKFWMRR-UHFFFAOYSA-N 1 1 389.297 3.244 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cccc(C)c2Br)[C@H](C)C1 ZINC000156348681 565081176 /nfs/dbraw/zinc/08/11/76/565081176.db2.gz TXQNIXSQHXOCOZ-ZIAGYGMSSA-N 1 1 389.359 3.108 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1S(=O)(=O)c1cccc(C)c1Br ZINC000156438930 565086726 /nfs/dbraw/zinc/08/67/26/565086726.db2.gz ILAUHHOOEZRKCZ-AWEZNQCLSA-N 1 1 398.326 3.116 10 0 GGAEMO CNC(=O)[C@@H]([NH2+]Cc1csc(-c2ccc(Br)cc2)n1)C(C)C ZINC000183680612 565087637 /nfs/dbraw/zinc/08/76/37/565087637.db2.gz JNVWJDYLKVVNOS-AWEZNQCLSA-N 1 1 382.327 3.433 10 0 GGAEMO C[C@H]1CC[N@H+](Cc2cc3c(cc2Br)OCCO3)C[C@@H]1n1ccnc1 ZINC000156518436 565092161 /nfs/dbraw/zinc/09/21/61/565092161.db2.gz HZRFLIXCLRHLTR-BBRMVZONSA-N 1 1 392.297 3.500 10 0 GGAEMO C[C@H]1CC[N@@H+](Cc2cc3c(cc2Br)OCCO3)C[C@@H]1n1ccnc1 ZINC000156518436 565092164 /nfs/dbraw/zinc/09/21/64/565092164.db2.gz HZRFLIXCLRHLTR-BBRMVZONSA-N 1 1 392.297 3.500 10 0 GGAEMO C[C@H]1C[C@H](N(C)C(=O)c2c(O)cnc3c(Br)cccc32)CC[N@H+]1C ZINC000292013382 565092168 /nfs/dbraw/zinc/09/21/68/565092168.db2.gz UQYVPGGDVYDGDH-NWDGAFQWSA-N 1 1 392.297 3.258 10 0 GGAEMO C[C@H]1C[C@@H](N(C)C(=O)c2c(O)cnc3c(Br)cccc32)CC[N@H+]1C ZINC000292013385 565092632 /nfs/dbraw/zinc/09/26/32/565092632.db2.gz UQYVPGGDVYDGDH-RYUDHWBXSA-N 1 1 392.297 3.258 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2CCOc3ccc(Br)cc32)CC[N@H+]1C ZINC000266833210 565092844 /nfs/dbraw/zinc/09/28/44/565092844.db2.gz ZQFQRFNXAUQALZ-IVMMDQJWSA-N 1 1 396.329 3.397 10 0 GGAEMO CS(=O)(=O)c1ccccc1NC1CC([NH+]2CCC(C(F)(F)F)CC2)C1 ZINC000369536942 565096350 /nfs/dbraw/zinc/09/63/50/565096350.db2.gz MCKIZBYVYOFSCF-UHFFFAOYSA-N 1 1 376.444 3.307 10 0 GGAEMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2Br)C[C@]2(CCOC2)O1 ZINC000369545695 565096687 /nfs/dbraw/zinc/09/66/87/565096687.db2.gz JEZBJWLLYJKZMH-KDOFPFPSSA-N 1 1 397.313 3.048 10 0 GGAEMO C[N@H+]1CC[C@@]2(CCN(CC(=O)Nc3ccc(Cl)cc3C(F)(F)F)C2)C1 ZINC000292083442 565097054 /nfs/dbraw/zinc/09/70/54/565097054.db2.gz FZZRARPYENJHKK-MRXNPFEDSA-N 1 1 375.822 3.325 10 0 GGAEMO C[N@H+]1CC[C@@]2(CCN(Cc3nc(-c4cc(Br)cs4)no3)C2)C1 ZINC000292136562 565100446 /nfs/dbraw/zinc/10/04/46/565100446.db2.gz LVPUTPSWLAADLQ-OAHLLOKOSA-N 1 1 383.315 3.088 10 0 GGAEMO C[C@H](NC(=O)C[NH2+][C@H](CO)c1cccc(Br)c1)c1cccs1 ZINC000183885099 565101463 /nfs/dbraw/zinc/10/14/63/565101463.db2.gz XHBJBEPAJBFKDN-SMDDNHRTSA-N 1 1 383.311 3.011 10 0 GGAEMO COC(=O)c1ccc(C[NH2+][C@H](CO)c2cccc(Br)c2)c(F)c1 ZINC000183891294 565101718 /nfs/dbraw/zinc/10/17/18/565101718.db2.gz OIOSTAUZDOHJDY-MRXNPFEDSA-N 1 1 382.229 3.198 10 0 GGAEMO CC(C)OCC[NH+]1CCN(C(=O)c2c[nH]c3cccc(Br)c23)CC1 ZINC000156711296 565102100 /nfs/dbraw/zinc/10/21/00/565102100.db2.gz NJXPQVBYUASNHK-UHFFFAOYSA-N 1 1 394.313 3.113 10 0 GGAEMO OC[C@H]([NH2+]Cc1cncc(Br)c1)c1cccc(Br)c1 ZINC000183908813 565102935 /nfs/dbraw/zinc/10/29/35/565102935.db2.gz KCUMHYKHUFLQMB-AWEZNQCLSA-N 1 1 386.087 3.430 10 0 GGAEMO Cc1ccc(NC(=O)C[NH2+][C@H](CO)c2cccc(Br)c2)c(C)c1 ZINC000183908228 565102314 /nfs/dbraw/zinc/10/23/14/565102314.db2.gz REIZOFIGPNMHTE-QGZVFWFLSA-N 1 1 377.282 3.328 10 0 GGAEMO C[C@@H](CC(=O)OC(C)(C)C)[NH2+]Cc1nnc(-c2ccc(Br)cc2)[nH]1 ZINC000183908284 565102623 /nfs/dbraw/zinc/10/26/23/565102623.db2.gz PSRUQCUCLPKTSB-NSHDSACASA-N 1 1 395.301 3.444 10 0 GGAEMO CCN(C(=O)C[NH2+][C@H](CO)c1cccc(Br)c1)c1ccccc1 ZINC000183911192 565102666 /nfs/dbraw/zinc/10/26/66/565102666.db2.gz YODIEGODWRKVQQ-QGZVFWFLSA-N 1 1 377.282 3.125 10 0 GGAEMO CCN(C(=O)C[NH2+][C@@H](CO)c1cccc(Br)c1)c1ccccc1 ZINC000183911175 565103079 /nfs/dbraw/zinc/10/30/79/565103079.db2.gz YODIEGODWRKVQQ-KRWDZBQOSA-N 1 1 377.282 3.125 10 0 GGAEMO C[C@@H]1Cc2ccccc2N1C(=O)C[NH2+][C@H](CO)c1cccc(Br)c1 ZINC000183905382 565103109 /nfs/dbraw/zinc/10/31/09/565103109.db2.gz UVOWSJMAQDTBPY-CXAGYDPISA-N 1 1 389.293 3.050 10 0 GGAEMO O=C(C[NH2+][C@@H](CO)c1cccc(Br)c1)NCCC1CCCCC1 ZINC000183912647 565103128 /nfs/dbraw/zinc/10/31/28/565103128.db2.gz RTEVRSJRRPGVSJ-KRWDZBQOSA-N 1 1 383.330 3.159 10 0 GGAEMO CCc1oc(C(=O)OC)cc1C[NH2+][C@@H](CO)c1cccc(Br)c1 ZINC000183909218 565103175 /nfs/dbraw/zinc/10/31/75/565103175.db2.gz ZVRVKRDOUVVRBQ-AWEZNQCLSA-N 1 1 382.254 3.214 10 0 GGAEMO CCc1oc(C(=O)OC)cc1C[NH2+][C@H](CO)c1cccc(Br)c1 ZINC000183909235 565103238 /nfs/dbraw/zinc/10/32/38/565103238.db2.gz ZVRVKRDOUVVRBQ-CQSZACIVSA-N 1 1 382.254 3.214 10 0 GGAEMO O=C(C[NH2+][C@H](CO)c1cccc(Br)c1)NCCC1CCCCC1 ZINC000183912627 565103259 /nfs/dbraw/zinc/10/32/59/565103259.db2.gz RTEVRSJRRPGVSJ-QGZVFWFLSA-N 1 1 383.330 3.159 10 0 GGAEMO C[C@H]1Cc2ccccc2N1C(=O)C[NH2+][C@@H](CO)c1cccc(Br)c1 ZINC000183905360 565103268 /nfs/dbraw/zinc/10/32/68/565103268.db2.gz UVOWSJMAQDTBPY-GUYCJALGSA-N 1 1 389.293 3.050 10 0 GGAEMO Cc1ccc(NC(=O)C[NH2+][C@@H](CO)c2cccc(Br)c2)cc1C ZINC000183919180 565104216 /nfs/dbraw/zinc/10/42/16/565104216.db2.gz NJDMZISLAFFQFM-KRWDZBQOSA-N 1 1 377.282 3.328 10 0 GGAEMO O=C(C[NH2+][C@H](CO)c1cccc(Br)c1)Nc1ccc(Cl)cc1 ZINC000183915458 565104725 /nfs/dbraw/zinc/10/47/25/565104725.db2.gz DUFODYXSIQRSFN-OAHLLOKOSA-N 1 1 383.673 3.364 10 0 GGAEMO C[N@@H+](Cc1ccc(Br)c(F)c1)C1CCN(c2cnccn2)CC1 ZINC000370043584 565125499 /nfs/dbraw/zinc/12/54/99/565125499.db2.gz SQCLMTYTABADSL-UHFFFAOYSA-N 1 1 379.277 3.479 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)Cc1c[nH]c2cccc(Br)c12 ZINC000157289415 565127077 /nfs/dbraw/zinc/12/70/77/565127077.db2.gz UOFTZGIOZMNPDE-AWEZNQCLSA-N 1 1 378.314 3.416 10 0 GGAEMO COc1cc(NC(=O)C[N@H+](C)CCc2ncc(C)s2)c(OC)cc1Cl ZINC000157437952 565132179 /nfs/dbraw/zinc/13/21/79/565132179.db2.gz FOXCXAGAIRQDDM-UHFFFAOYSA-N 1 1 383.901 3.235 10 0 GGAEMO COc1cc(NC(=O)C[N@@H+](C)CCc2ncc(C)s2)c(OC)cc1Cl ZINC000157437952 565132184 /nfs/dbraw/zinc/13/21/84/565132184.db2.gz FOXCXAGAIRQDDM-UHFFFAOYSA-N 1 1 383.901 3.235 10 0 GGAEMO Cc1nnc([C@H]2CCC[N@@H+](C[C@](C)(O)c3ccc(Br)cc3F)C2)[nH]1 ZINC000292774491 565133122 /nfs/dbraw/zinc/13/31/22/565133122.db2.gz KALLMIRCRCHBNX-SJCJKPOMSA-N 1 1 397.292 3.102 10 0 GGAEMO Cc1n[nH]c([C@H]2CCC[N@H+](C[C@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292774491 565133123 /nfs/dbraw/zinc/13/31/23/565133123.db2.gz KALLMIRCRCHBNX-SJCJKPOMSA-N 1 1 397.292 3.102 10 0 GGAEMO Cc1n[nH]c([C@H]2CCC[N@@H+](C[C@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292774491 565133127 /nfs/dbraw/zinc/13/31/27/565133127.db2.gz KALLMIRCRCHBNX-SJCJKPOMSA-N 1 1 397.292 3.102 10 0 GGAEMO Cc1nc([C@H]2CCC[N@H+](C[C@](C)(O)c3ccc(Br)cc3F)C2)n[nH]1 ZINC000292774491 565133130 /nfs/dbraw/zinc/13/31/30/565133130.db2.gz KALLMIRCRCHBNX-SJCJKPOMSA-N 1 1 397.292 3.102 10 0 GGAEMO Cc1nc([C@H]2CCC[N@@H+](C[C@](C)(O)c3ccc(Br)cc3F)C2)n[nH]1 ZINC000292774491 565133133 /nfs/dbraw/zinc/13/31/33/565133133.db2.gz KALLMIRCRCHBNX-SJCJKPOMSA-N 1 1 397.292 3.102 10 0 GGAEMO Cc1nnc([C@H]2CCC[N@@H+](C[C@@](C)(O)c3ccc(Br)cc3F)C2)[nH]1 ZINC000292774496 565134176 /nfs/dbraw/zinc/13/41/76/565134176.db2.gz KALLMIRCRCHBNX-YVEFUNNKSA-N 1 1 397.292 3.102 10 0 GGAEMO Cc1n[nH]c([C@H]2CCC[N@H+](C[C@@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292774496 565134180 /nfs/dbraw/zinc/13/41/80/565134180.db2.gz KALLMIRCRCHBNX-YVEFUNNKSA-N 1 1 397.292 3.102 10 0 GGAEMO Cc1n[nH]c([C@H]2CCC[N@@H+](C[C@@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292774496 565134182 /nfs/dbraw/zinc/13/41/82/565134182.db2.gz KALLMIRCRCHBNX-YVEFUNNKSA-N 1 1 397.292 3.102 10 0 GGAEMO Cc1nc([C@H]2CCC[N@H+](C[C@@](C)(O)c3ccc(Br)cc3F)C2)n[nH]1 ZINC000292774496 565134185 /nfs/dbraw/zinc/13/41/85/565134185.db2.gz KALLMIRCRCHBNX-YVEFUNNKSA-N 1 1 397.292 3.102 10 0 GGAEMO Cc1nc([C@H]2CCC[N@@H+](C[C@@](C)(O)c3ccc(Br)cc3F)C2)n[nH]1 ZINC000292774496 565134189 /nfs/dbraw/zinc/13/41/89/565134189.db2.gz KALLMIRCRCHBNX-YVEFUNNKSA-N 1 1 397.292 3.102 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1nn(C)cc1Br ZINC000292853473 565138275 /nfs/dbraw/zinc/13/82/75/565138275.db2.gz GIOYIAPBSQABMQ-YOEHRIQHSA-N 1 1 377.330 3.183 10 0 GGAEMO O[C@@H](COC1CCOCC1)C[N@H+]1CCC[C@@H]1Cc1ccc(Br)cc1 ZINC000370346167 565139164 /nfs/dbraw/zinc/13/91/64/565139164.db2.gz AJGXXLIORNZOEB-QZTJIDSGSA-N 1 1 398.341 3.013 10 0 GGAEMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)NCc2cc(F)cc(Br)c2)C1 ZINC000157687734 565141314 /nfs/dbraw/zinc/14/13/14/565141314.db2.gz IFJCCSVJXJYVLW-ZDUSSCGKSA-N 1 1 386.309 3.365 10 0 GGAEMO C[N@H+]1CCC[C@@H]2CN(C(=O)c3c[nH]c4cccc(Br)c34)CC[C@@H]21 ZINC000157720002 565141911 /nfs/dbraw/zinc/14/19/11/565141911.db2.gz QTLBBQVTKOCGIF-WBMJQRKESA-N 1 1 376.298 3.487 10 0 GGAEMO COc1cc(C)c(Br)cc1NC(=O)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000184549560 565143768 /nfs/dbraw/zinc/14/37/68/565143768.db2.gz MVJRHXSJEOEPCA-CYBMUJFWSA-N 1 1 382.302 3.468 10 0 GGAEMO Cc1nc(C[NH+]2CCC(CNc3ncncc3Br)CC2)oc1C ZINC000268470100 565153562 /nfs/dbraw/zinc/15/35/62/565153562.db2.gz MEGNJJSOXMSHPR-UHFFFAOYSA-N 1 1 380.290 3.168 10 0 GGAEMO CC[C@@H](O)C[NH+]1CCN(C(=O)N[C@H](C)c2cc(F)c(Cl)cc2Cl)CC1 ZINC000184714303 565154228 /nfs/dbraw/zinc/15/42/28/565154228.db2.gz HWNUVWXUZFVWNP-VXGBXAGGSA-N 1 1 392.302 3.292 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)Nc1cc(F)c(Br)cc1C ZINC000184836311 565160390 /nfs/dbraw/zinc/16/03/90/565160390.db2.gz LADNGLGUXAPBFY-GFCCVEGCSA-N 1 1 388.281 3.129 10 0 GGAEMO CC[C@H](O)C[NH+]1CCN(C(=O)N[C@@H](C)c2c(Cl)ccc(F)c2Cl)CC1 ZINC000184922001 565166692 /nfs/dbraw/zinc/16/66/92/565166692.db2.gz HHIJICRLZLODEO-RYUDHWBXSA-N 1 1 392.302 3.292 10 0 GGAEMO CC(C)C(=O)NC[C@H]1CCC[N@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000184962308 565167155 /nfs/dbraw/zinc/16/71/55/565167155.db2.gz YOUNNOKDBPPWAW-CYBMUJFWSA-N 1 1 393.329 3.310 10 0 GGAEMO CC(C)C(=O)NC[C@H]1CCC[N@@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000184962308 565167156 /nfs/dbraw/zinc/16/71/56/565167156.db2.gz YOUNNOKDBPPWAW-CYBMUJFWSA-N 1 1 393.329 3.310 10 0 GGAEMO O=C(NCC1CC1)[C@@H]1CCC[N@@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000184948076 565167323 /nfs/dbraw/zinc/16/73/23/565167323.db2.gz CXENTSSZTDVLJP-CYBMUJFWSA-N 1 1 391.313 3.064 10 0 GGAEMO O=C(NCC1CC1)[C@@H]1CCC[N@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000184948076 565167327 /nfs/dbraw/zinc/16/73/27/565167327.db2.gz CXENTSSZTDVLJP-CYBMUJFWSA-N 1 1 391.313 3.064 10 0 GGAEMO CCO[C@H]1C[C@@H](O)C12CC[NH+](Cc1nc3cc(Br)ccc3[nH]1)CC2 ZINC000184974174 565168566 /nfs/dbraw/zinc/16/85/66/565168566.db2.gz VNTZVAFLDONMOC-CVEARBPZSA-N 1 1 394.313 3.077 10 0 GGAEMO CCn1cnnc1[C@@H]1CCC[N@@H+](C[C@H](O)c2ccc(F)c(Br)c2)C1 ZINC000184993496 565170827 /nfs/dbraw/zinc/17/08/27/565170827.db2.gz GTCRAKPMIDTYOW-CJNGLKHVSA-N 1 1 397.292 3.113 10 0 GGAEMO CCn1cnnc1[C@H]1CCC[N@@H+](C[C@H](O)c2ccc(F)c(Br)c2)C1 ZINC000184993512 565170874 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CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2ccc(C)c(C(F)(F)F)c2)[C@H](C)C1 ZINC000173257172 565541970 /nfs/dbraw/zinc/54/19/70/565541970.db2.gz NFWRBMRCLGCOCN-CJNGLKHVSA-N 1 1 378.460 3.365 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2ccc(F)cc2C(F)(F)F)[C@H](C)C1 ZINC000173260172 565542018 /nfs/dbraw/zinc/54/20/18/565542018.db2.gz DPKSHJHQHUUFJC-BXUZGUMPSA-N 1 1 382.423 3.195 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2F)[C@H](C)C1 ZINC000173260093 565542081 /nfs/dbraw/zinc/54/20/81/565542081.db2.gz VEJKOOVXBPVYLT-BXUZGUMPSA-N 1 1 382.423 3.195 10 0 GGAEMO CSc1cc(C(=O)N2CC[C@@H](C[N@@H+](C)Cc3scnc3C)C2)ccn1 ZINC000190568940 565542656 /nfs/dbraw/zinc/54/26/56/565542656.db2.gz ONNASJPWGAOATE-AWEZNQCLSA-N 1 1 376.551 3.163 10 0 GGAEMO C[C@@H]1C[C@H](N(C)S(=O)(=O)c2ccc(OC(F)F)c(Cl)c2)CC[N@H+]1C ZINC000173273603 565543003 /nfs/dbraw/zinc/54/30/03/565543003.db2.gz PSFAQNGMALQESI-GHMZBOCLSA-N 1 1 382.860 3.045 10 0 GGAEMO COCC[NH+]1[C@H](C)CN(c2nnc(Cc3ccc(Cl)cc3)s2)C[C@H]1C ZINC000302502687 565543407 /nfs/dbraw/zinc/54/34/07/565543407.db2.gz LUPXNHBOJKSZFI-ZIAGYGMSSA-N 1 1 380.945 3.328 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CC[N@H+]1C ZINC000173272734 565543575 /nfs/dbraw/zinc/54/35/75/565543575.db2.gz HYBJPSIASSRXPA-PWSUYJOCSA-N 1 1 384.851 3.462 10 0 GGAEMO C[C@H]1C[C@@H](N(C)S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)CC[N@H+]1C ZINC000173272752 565543631 /nfs/dbraw/zinc/54/36/31/565543631.db2.gz HYBJPSIASSRXPA-JQWIXIFHSA-N 1 1 384.851 3.462 10 0 GGAEMO C[N@H+](Cc1cccnc1)C[C@@H]1CCN(C(=O)c2coc(Br)c2)C1 ZINC000190587751 565544140 /nfs/dbraw/zinc/54/41/40/565544140.db2.gz CSLUEKDWMMPXIE-AWEZNQCLSA-N 1 1 378.270 3.031 10 0 GGAEMO Cn1ncc(Br)c1CN[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@H]12 ZINC000383871745 565544492 /nfs/dbraw/zinc/54/44/92/565544492.db2.gz HWZMOENBHDMWKG-SOLBZPMBSA-N 1 1 389.341 3.183 10 0 GGAEMO CC[C@H]1[C@H](CO)CC[N@@H+]1CC(=O)Nc1ccc(Br)cc1Cl ZINC000385750418 565545676 /nfs/dbraw/zinc/54/56/76/565545676.db2.gz CXKBXJLWDGLLCB-HZMBPMFUSA-N 1 1 375.694 3.134 10 0 GGAEMO CC[C@H]1[C@H](CO)CC[N@H+]1CC(=O)Nc1ccc(Br)cc1Cl ZINC000385750418 565545681 /nfs/dbraw/zinc/54/56/81/565545681.db2.gz CXKBXJLWDGLLCB-HZMBPMFUSA-N 1 1 375.694 3.134 10 0 GGAEMO C[N@H+](Cc1cccnc1)C[C@H]1CCN(C(=O)c2nc(Cl)ccc2Cl)C1 ZINC000190612505 565545951 /nfs/dbraw/zinc/54/59/51/565545951.db2.gz MCPMNADNSFAHLM-CQSZACIVSA-N 1 1 379.291 3.378 10 0 GGAEMO O=S(=O)(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)c1c(Cl)cccc1Br ZINC000385913424 565546386 /nfs/dbraw/zinc/54/63/86/565546386.db2.gz HUYUCAXKQWYJDF-OLZOCXBDSA-N 1 1 393.734 3.008 10 0 GGAEMO CC[C@@H]1C[N@@H+](C)CCCN1S(=O)(=O)c1c(Cl)cccc1Br ZINC000386147378 565546949 /nfs/dbraw/zinc/54/69/49/565546949.db2.gz ZFMGCVGAOGRGAN-LLVKDONJSA-N 1 1 395.750 3.207 10 0 GGAEMO Fc1ccc(Br)cc1-c1nnc(N2CC[N@H+]3CCC[C@H]3C2)s1 ZINC000302615463 565547182 /nfs/dbraw/zinc/54/71/82/565547182.db2.gz FVVWXOWSJQTJHV-NSHDSACASA-N 1 1 383.290 3.391 10 0 GGAEMO C[N@H+]1CCC[C@@H](CNS(=O)(=O)Cc2ccccc2F)[C@@H]1c1cccs1 ZINC000173323309 565547683 /nfs/dbraw/zinc/54/76/83/565547683.db2.gz NUZYQAJNQJEFER-KBXCAEBGSA-N 1 1 382.526 3.390 10 0 GGAEMO CC(C)[N@@H+](C)CC(=O)N1CCC[C@H]1c1ccc(I)cc1 ZINC000173323347 565547780 /nfs/dbraw/zinc/54/77/80/565547780.db2.gz VYOOITWCXMYILZ-HNNXBMFYSA-N 1 1 386.277 3.295 10 0 GGAEMO C[N@@H+]1CCC[C@H](CNS(=O)(=O)c2c(F)cccc2F)[C@@H]1c1cccs1 ZINC000173324064 565547800 /nfs/dbraw/zinc/54/78/00/565547800.db2.gz HGEYYVPZRDKFAH-MLGOLLRUSA-N 1 1 386.489 3.388 10 0 GGAEMO C[N@H+]1CCC[C@H](CNS(=O)(=O)c2c(F)cccc2F)[C@@H]1c1cccs1 ZINC000173324064 565547804 /nfs/dbraw/zinc/54/78/04/565547804.db2.gz HGEYYVPZRDKFAH-MLGOLLRUSA-N 1 1 386.489 3.388 10 0 GGAEMO Cn1cc([C@@H]2CCC[N@H+]2CCC(=O)Nc2ccccc2Br)cn1 ZINC000173320503 565547927 /nfs/dbraw/zinc/54/79/27/565547927.db2.gz ROSXDFIDVGVQFX-INIZCTEOSA-N 1 1 377.286 3.348 10 0 GGAEMO Cn1cc([C@H]2CCC[N@H+]2CCC(=O)Nc2ccccc2Br)cn1 ZINC000173320516 565547989 /nfs/dbraw/zinc/54/79/89/565547989.db2.gz ROSXDFIDVGVQFX-MRXNPFEDSA-N 1 1 377.286 3.348 10 0 GGAEMO C[N@@H+]1CCC[C@@H](CNS(=O)(=O)c2c(F)cccc2F)[C@@H]1c1cccs1 ZINC000173324081 565548314 /nfs/dbraw/zinc/54/83/14/565548314.db2.gz HGEYYVPZRDKFAH-BLLLJJGKSA-N 1 1 386.489 3.388 10 0 GGAEMO C[N@H+]1CCC[C@@H](CNS(=O)(=O)c2c(F)cccc2F)[C@@H]1c1cccs1 ZINC000173324081 565548317 /nfs/dbraw/zinc/54/83/17/565548317.db2.gz HGEYYVPZRDKFAH-BLLLJJGKSA-N 1 1 386.489 3.388 10 0 GGAEMO Cn1ncc(Br)c1CNCC1([N@@H+](C)Cc2ccccc2)CCC1 ZINC000387415696 565549384 /nfs/dbraw/zinc/54/93/84/565549384.db2.gz MSUHGXAWZIURBR-UHFFFAOYSA-N 1 1 377.330 3.327 10 0 GGAEMO CN(Cc1ccccc1)C1(C[NH2+]Cc2c(Br)cnn2C)CCC1 ZINC000387415696 565549387 /nfs/dbraw/zinc/54/93/87/565549387.db2.gz MSUHGXAWZIURBR-UHFFFAOYSA-N 1 1 377.330 3.327 10 0 GGAEMO Cc1ncsc1C[N@@H+](C)C[C@@H]1CCN(C(=O)Nc2ccc(Cl)cn2)C1 ZINC000190673575 565551416 /nfs/dbraw/zinc/55/14/16/565551416.db2.gz FGUAZHXNJOHTNP-ZDUSSCGKSA-N 1 1 379.917 3.486 10 0 GGAEMO Cc1ncsc1C[N@@H+](C)C[C@H]1CCN(C(=O)Nc2ccc(Cl)cn2)C1 ZINC000190673598 565551776 /nfs/dbraw/zinc/55/17/76/565551776.db2.gz FGUAZHXNJOHTNP-CYBMUJFWSA-N 1 1 379.917 3.486 10 0 GGAEMO C[C@@H]1C[C@@H](NCc2c(Br)cnn2C)CC[N@H+]1Cc1ccccc1 ZINC000278328336 565552325 /nfs/dbraw/zinc/55/23/25/565552325.db2.gz FRCVVLNZYYIFNK-ZBFHGGJFSA-N 1 1 377.330 3.325 10 0 GGAEMO Cn1ncc(Br)c1C[NH2+]Cc1ccc(Br)c(F)c1 ZINC000278346201 565553095 /nfs/dbraw/zinc/55/30/95/565553095.db2.gz HHYBJAFOKFQGJV-UHFFFAOYSA-N 1 1 377.055 3.374 10 0 GGAEMO CC[N@@H+]1CC[C@H](NCc2cc(Br)c(OC)c(Br)c2)C1 ZINC000389281806 565553197 /nfs/dbraw/zinc/55/31/97/565553197.db2.gz UTRUDPBMQQRZTH-NSHDSACASA-N 1 1 392.135 3.404 10 0 GGAEMO CC[N@H+]1CC[C@H](NCc2cc(Br)c(OC)c(Br)c2)C1 ZINC000389281806 565553205 /nfs/dbraw/zinc/55/32/05/565553205.db2.gz UTRUDPBMQQRZTH-NSHDSACASA-N 1 1 392.135 3.404 10 0 GGAEMO CC(C)NC(=O)Nc1ccc(C[NH2+]Cc2c(Br)cnn2C)cc1 ZINC000278379533 565554076 /nfs/dbraw/zinc/55/40/76/565554076.db2.gz LGDPAXJGJKCTMK-UHFFFAOYSA-N 1 1 380.290 3.002 10 0 GGAEMO CC[N@H+]1CC[C@H](NC(=O)c2cc(Br)cc(Br)c2)C1 ZINC000389964465 565554750 /nfs/dbraw/zinc/55/47/50/565554750.db2.gz GKXOXAOCOPOVHL-LBPRGKRZSA-N 1 1 376.092 3.036 10 0 GGAEMO OCC[N@H+]1CCCN(c2ccnc3c(Cl)cc(Br)cc23)CC1 ZINC000302742382 565554737 /nfs/dbraw/zinc/55/47/37/565554737.db2.gz QYPUJQDNKRJGRT-UHFFFAOYSA-N 1 1 384.705 3.155 10 0 GGAEMO C[C@@H](CNC(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1)CN1CC[NH+](C)CC1 ZINC000173398842 565555507 /nfs/dbraw/zinc/55/55/07/565555507.db2.gz FALMGFPXMKOFOG-KBPBESRZSA-N 1 1 387.355 3.237 10 0 GGAEMO C[C@@H](COCc1ccccc1)[NH2+]Cc1ncc(I)s1 ZINC000390574833 565557261 /nfs/dbraw/zinc/55/72/61/565557261.db2.gz DZJJCGMYMQPYHQ-NSHDSACASA-N 1 1 388.274 3.443 10 0 GGAEMO C[C@H]1CN(c2ccnc3c(Cl)cc(Br)cc23)CC[N@H+]1CCO ZINC000302798412 565557523 /nfs/dbraw/zinc/55/75/23/565557523.db2.gz RKBWDWSTMYUOFE-NSHDSACASA-N 1 1 384.705 3.154 10 0 GGAEMO C[C@H](COCc1ccccc1)[NH2+]Cc1ncc(I)s1 ZINC000390574832 565557697 /nfs/dbraw/zinc/55/76/97/565557697.db2.gz DZJJCGMYMQPYHQ-LLVKDONJSA-N 1 1 388.274 3.443 10 0 GGAEMO COc1nc(N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(F)c(F)c2)ncc1Br ZINC000302800232 565557963 /nfs/dbraw/zinc/55/79/63/565557963.db2.gz BZKPHIGKLCOVNA-UONOGXRCSA-N 1 1 399.239 3.383 10 0 GGAEMO COc1nc(N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)c(F)c2)ncc1Br ZINC000302800232 565557966 /nfs/dbraw/zinc/55/79/66/565557966.db2.gz BZKPHIGKLCOVNA-UONOGXRCSA-N 1 1 399.239 3.383 10 0 GGAEMO Cn1ncc(Br)c1C[NH2+]Cc1cccc(OCC(F)(F)F)c1 ZINC000278425228 565558039 /nfs/dbraw/zinc/55/80/39/565558039.db2.gz RFJRIMLHXHYQJE-UHFFFAOYSA-N 1 1 378.192 3.414 10 0 GGAEMO CCNC(=O)CC[N@H+]1CCC[C@@H]1c1nc(-c2ccccc2Br)no1 ZINC000190784401 565558356 /nfs/dbraw/zinc/55/83/56/565558356.db2.gz FNUDAUIYFYPGKI-CQSZACIVSA-N 1 1 393.285 3.162 10 0 GGAEMO CCOC(=O)C1CCC(O)(C[N@@H+](C)Cc2ccc(Br)s2)CC1 ZINC000190799540 565559934 /nfs/dbraw/zinc/55/99/34/565559934.db2.gz BUBVDEACOKSAON-UHFFFAOYSA-N 1 1 390.343 3.427 10 0 GGAEMO C[N@H+]1CCCC[C@@H]1CN1CCN(c2ncc(Cl)cc2Br)CC1 ZINC000302835996 565560417 /nfs/dbraw/zinc/56/04/17/565560417.db2.gz WCSCPFQPUZXZDG-CQSZACIVSA-N 1 1 387.753 3.104 10 0 GGAEMO CC[N@@H+](Cc1c(Br)cnn1C)CC1CCN(c2ccccn2)CC1 ZINC000278478554 565561239 /nfs/dbraw/zinc/56/12/39/565561239.db2.gz RNWJHDWRXUZEPH-UHFFFAOYSA-N 1 1 392.345 3.316 10 0 GGAEMO CC[N@H+](Cc1c(Br)cnn1C)CC1CCN(c2ccccn2)CC1 ZINC000278478554 565561243 /nfs/dbraw/zinc/56/12/43/565561243.db2.gz RNWJHDWRXUZEPH-UHFFFAOYSA-N 1 1 392.345 3.316 10 0 GGAEMO COCC[N@@H+]1CCN(C(=O)Nc2cc(Br)c(F)cc2C)C[C@@H]1C ZINC000190877685 565566690 /nfs/dbraw/zinc/56/66/90/565566690.db2.gz FXFDNGFETPOYPP-LBPRGKRZSA-N 1 1 388.281 3.081 10 0 GGAEMO COCC[N@H+]1CCN(C(=O)Nc2cc(Br)c(F)cc2C)C[C@@H]1C ZINC000190877685 565566697 /nfs/dbraw/zinc/56/66/97/565566697.db2.gz FXFDNGFETPOYPP-LBPRGKRZSA-N 1 1 388.281 3.081 10 0 GGAEMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1c(Br)cnn1C ZINC000278580831 565566874 /nfs/dbraw/zinc/56/68/74/565566874.db2.gz YNIRIDSVEWWAQI-RHSMWYFYSA-N 1 1 377.330 3.183 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)Nc1cc(Br)c(F)cc1C ZINC000190918197 565570090 /nfs/dbraw/zinc/57/00/90/565570090.db2.gz SWSLDIUWSVHMOW-GFCCVEGCSA-N 1 1 388.281 3.129 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccn(-c2cccc(Br)c2)n1 ZINC000303292528 565570301 /nfs/dbraw/zinc/57/03/01/565570301.db2.gz LETKBFAXQKUKTA-CQSZACIVSA-N 1 1 391.313 3.239 10 0 GGAEMO CCn1cnnc1[C@@H]1CCC[N@H+](Cc2ccc(I)cc2)C1 ZINC000173608843 565570726 /nfs/dbraw/zinc/57/07/26/565570726.db2.gz YRTVZAUTTBNVGE-CQSZACIVSA-N 1 1 396.276 3.282 10 0 GGAEMO CCn1cnnc1[C@@H]1CCC[N@@H+](Cc2ccc(I)cc2)C1 ZINC000173608843 565570730 /nfs/dbraw/zinc/57/07/30/565570730.db2.gz YRTVZAUTTBNVGE-CQSZACIVSA-N 1 1 396.276 3.282 10 0 GGAEMO CC[C@H]1CN(C(=O)c2scc(C)c2Br)CC[N@@H+]1CCOC ZINC000190940287 565571485 /nfs/dbraw/zinc/57/14/85/565571485.db2.gz YDYYPVKPYVMGQW-LBPRGKRZSA-N 1 1 375.332 3.002 10 0 GGAEMO CC[C@H]1CN(C(=O)c2scc(C)c2Br)CC[N@H+]1CCOC ZINC000190940287 565571492 /nfs/dbraw/zinc/57/14/92/565571492.db2.gz YDYYPVKPYVMGQW-LBPRGKRZSA-N 1 1 375.332 3.002 10 0 GGAEMO COC(=O)[C@H]1CCC[N@H+](Cc2ncc(-c3cccc(Br)c3)o2)C1 ZINC000173626508 565571596 /nfs/dbraw/zinc/57/15/96/565571596.db2.gz RJRNAZBEGZPJRD-ZDUSSCGKSA-N 1 1 379.254 3.489 10 0 GGAEMO COC(=O)[C@H]1CCC[N@@H+](Cc2ncc(-c3cccc(Br)c3)o2)C1 ZINC000173626508 565571602 /nfs/dbraw/zinc/57/16/02/565571602.db2.gz RJRNAZBEGZPJRD-ZDUSSCGKSA-N 1 1 379.254 3.489 10 0 GGAEMO CC[N@H+]1CCC[C@@H](NCc2c(Br)cncc2Br)C1 ZINC000394594867 565572147 /nfs/dbraw/zinc/57/21/47/565572147.db2.gz BRZUEBZABLLMAL-SNVBAGLBSA-N 1 1 377.124 3.181 10 0 GGAEMO Cc1ccc([C@@H](C[NH2+]Cc2ncc(C(F)(F)F)s2)N2CCOCC2)o1 ZINC000278692734 565572736 /nfs/dbraw/zinc/57/27/36/565572736.db2.gz QDBRQRPKAWVALD-GFCCVEGCSA-N 1 1 375.416 3.226 10 0 GGAEMO C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000173660427 565574725 /nfs/dbraw/zinc/57/47/25/565574725.db2.gz JPAUVNKFKXMLGQ-YPMHNXCESA-N 1 1 378.270 3.190 10 0 GGAEMO Cn1ncc(Br)c1CNC[C@@]1(C)CCC[N@H+]1Cc1ccccc1 ZINC000397911631 565576871 /nfs/dbraw/zinc/57/68/71/565576871.db2.gz IACAKCXSRDZFHB-GOSISDBHSA-N 1 1 377.330 3.327 10 0 GGAEMO Cn1ncc(Br)c1C[NH2+]C[C@@]1(C)CCCN1Cc1ccccc1 ZINC000397911631 565576876 /nfs/dbraw/zinc/57/68/76/565576876.db2.gz IACAKCXSRDZFHB-GOSISDBHSA-N 1 1 377.330 3.327 10 0 GGAEMO COCC[N@H+](Cc1cccnc1)C[C@@H](O)COc1c(Cl)cccc1Cl ZINC000191107118 565583042 /nfs/dbraw/zinc/58/30/42/565583042.db2.gz VNPSCTJNXGLTQU-OAHLLOKOSA-N 1 1 385.291 3.277 10 0 GGAEMO C[C@@H]1[C@H](NC(=O)c2nscc2Br)CC[N@H+]1Cc1ccccc1 ZINC000404939376 565583714 /nfs/dbraw/zinc/58/37/14/565583714.db2.gz LKIIDWPMOUFQJR-BXUZGUMPSA-N 1 1 380.311 3.298 10 0 GGAEMO O=C(c1nscc1Br)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000404712371 565583785 /nfs/dbraw/zinc/58/37/85/565583785.db2.gz NRRXODMGFAJCKX-UHFFFAOYSA-N 1 1 380.311 3.254 10 0 GGAEMO C[C@@H]1C[C@@H](NC(=O)c2nscc2Br)C[N@H+]1Cc1ccccc1 ZINC000404817782 565583870 /nfs/dbraw/zinc/58/38/70/565583870.db2.gz QSQGLRDVJSCFBY-DGCLKSJQSA-N 1 1 380.311 3.298 10 0 GGAEMO C[C@H]([NH2+]Cc1ccc(I)cc1)c1nnc2n1CCCCC2 ZINC000313739928 565584760 /nfs/dbraw/zinc/58/47/60/565584760.db2.gz AMJQXWSMRSSUSG-LBPRGKRZSA-N 1 1 396.276 3.460 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)NCCCNc1ccc(C)c[nH+]1 ZINC000173782186 565584836 /nfs/dbraw/zinc/58/48/36/565584836.db2.gz REDFVYXRPDZOQH-UHFFFAOYSA-N 1 1 392.297 3.322 10 0 GGAEMO O=C(N[C@H]1CCC[N@@H+](Cc2ccccc2)C1)c1nscc1Br ZINC000404970634 565585299 /nfs/dbraw/zinc/58/52/99/565585299.db2.gz ZMVJYIQEDURIEJ-ZDUSSCGKSA-N 1 1 380.311 3.300 10 0 GGAEMO O=C1C[C@]2(CC[N@H+](Cc3csc(-c4cccc(Br)c4)n3)C2)CN1 ZINC000278973140 565587649 /nfs/dbraw/zinc/58/76/49/565587649.db2.gz YCELZQROBLGTPW-QGZVFWFLSA-N 1 1 392.322 3.285 10 0 GGAEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1S(=O)(=O)c1ccc(F)cc1C(F)(F)F ZINC000173829878 565590851 /nfs/dbraw/zinc/59/08/51/565590851.db2.gz JVPMVFVTJLLXMY-CHWSQXEVSA-N 1 1 380.407 3.092 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1S(=O)(=O)c1ccc(C)cc1Br ZINC000173841200 565592251 /nfs/dbraw/zinc/59/22/51/565592251.db2.gz KRGMALWVIBHEMC-AWEZNQCLSA-N 1 1 398.326 3.116 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CN1CCN(C(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)CC1 ZINC000279080897 565594243 /nfs/dbraw/zinc/59/42/43/565594243.db2.gz RZGBJWGCGAANRZ-ARFHVFGLSA-N 1 1 381.973 3.134 10 0 GGAEMO COc1cc(Cl)c(S(=O)(=O)N[C@H]2C[N@H+](C(C)C)C[C@H]2C)cc1Cl ZINC000173885119 565596956 /nfs/dbraw/zinc/59/69/56/565596956.db2.gz WYYCTQNKOPAEAC-MFKMUULPSA-N 1 1 381.325 3.009 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(S(=O)(=O)c2cc(C)cc(Br)c2)CC1 ZINC000408192959 565598499 /nfs/dbraw/zinc/59/84/99/565598499.db2.gz PIBKBAORLQZLKU-UHFFFAOYSA-N 1 1 398.326 3.288 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)C1(c2ccccc2Br)CC1 ZINC000191425435 565602917 /nfs/dbraw/zinc/60/29/17/565602917.db2.gz GUVCJRSVBYDDEB-ZDUSSCGKSA-N 1 1 376.298 3.438 10 0 GGAEMO O=c1cc(C[N@@H+](Cc2cccc(Br)c2)CC2CC2)[nH]c2ccnn21 ZINC000191450431 565605592 /nfs/dbraw/zinc/60/55/92/565605592.db2.gz CXFCHHWFWDSNCV-UHFFFAOYSA-N 1 1 387.281 3.197 10 0 GGAEMO COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CC[NH+](C2CC2)CC1 ZINC000191456781 565605811 /nfs/dbraw/zinc/60/58/11/565605811.db2.gz KXNQTGZAUGDDQP-GFCCVEGCSA-N 1 1 382.302 3.008 10 0 GGAEMO O=C(C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O)Nc1ccc(Br)cc1 ZINC000322656188 565610872 /nfs/dbraw/zinc/61/08/72/565610872.db2.gz ZJADWMRICATEQQ-BBWFWOEESA-N 1 1 381.314 3.403 10 0 GGAEMO Cc1nn(-c2cccc(Cl)c2)c(Cl)c1C[N@@H+]1CC[C@@]2(CNC(=O)C2)C1 ZINC000279525456 565617470 /nfs/dbraw/zinc/61/74/70/565617470.db2.gz YTCYQWJBMGJCDX-GOSISDBHSA-N 1 1 379.291 3.200 10 0 GGAEMO Cc1nn(-c2cccc(Cl)c2)c(Cl)c1C[N@H+]1CC[C@@]2(CNC(=O)C2)C1 ZINC000279525456 565617474 /nfs/dbraw/zinc/61/74/74/565617474.db2.gz YTCYQWJBMGJCDX-GOSISDBHSA-N 1 1 379.291 3.200 10 0 GGAEMO CCc1cnc(CCNC(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)s1 ZINC000174160673 565618127 /nfs/dbraw/zinc/61/81/27/565618127.db2.gz VLNYVMCLZCAGQG-CYBMUJFWSA-N 1 1 378.567 3.056 10 0 GGAEMO CCc1cnc(CCNC(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)s1 ZINC000174160673 565618133 /nfs/dbraw/zinc/61/81/33/565618133.db2.gz VLNYVMCLZCAGQG-CYBMUJFWSA-N 1 1 378.567 3.056 10 0 GGAEMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1cc(F)c(Br)cc1Cl ZINC000279547488 565618823 /nfs/dbraw/zinc/61/88/23/565618823.db2.gz AIJCKORZNHFSEP-SECBINFHSA-N 1 1 375.669 3.456 10 0 GGAEMO COc1ccc(C[N@@H+]2CCCC[C@H]2CN2CCOCC2)cc1Br ZINC000174177754 565619040 /nfs/dbraw/zinc/61/90/40/565619040.db2.gz OHDGRJLAQRINIK-INIZCTEOSA-N 1 1 383.330 3.144 10 0 GGAEMO COc1ccc(C[N@H+]2CCCC[C@H]2CN2CCOCC2)cc1Br ZINC000174177754 565619043 /nfs/dbraw/zinc/61/90/43/565619043.db2.gz OHDGRJLAQRINIK-INIZCTEOSA-N 1 1 383.330 3.144 10 0 GGAEMO COc1ccc(CN2CCCC[C@H]2C[NH+]2CCOCC2)cc1Br ZINC000174177754 565619048 /nfs/dbraw/zinc/61/90/48/565619048.db2.gz OHDGRJLAQRINIK-INIZCTEOSA-N 1 1 383.330 3.144 10 0 GGAEMO CC[N@H+]1CC[C@H](CNC(=O)c2ccc(Sc3ccccc3Cl)nn2)C1 ZINC000174180111 565619397 /nfs/dbraw/zinc/61/93/97/565619397.db2.gz JRKJHWBDLMZNSH-CYBMUJFWSA-N 1 1 376.913 3.353 10 0 GGAEMO Cc1cccc(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1I ZINC000174219582 565621652 /nfs/dbraw/zinc/62/16/52/565621652.db2.gz VAKUVQXXWSXYLQ-AGUYFDCRSA-N 1 1 398.288 3.345 10 0 GGAEMO COCC[N@@H+]1CCN(C(=O)c2cc(Br)cc(OC(C)C)c2)C[C@@H]1C ZINC000174248056 565623897 /nfs/dbraw/zinc/62/38/97/565623897.db2.gz UBFXMYZPZDKFPC-AWEZNQCLSA-N 1 1 399.329 3.029 10 0 GGAEMO COCC[N@H+]1CCN(C(=O)c2cc(Br)cc(OC(C)C)c2)C[C@@H]1C ZINC000174248056 565623901 /nfs/dbraw/zinc/62/39/01/565623901.db2.gz UBFXMYZPZDKFPC-AWEZNQCLSA-N 1 1 399.329 3.029 10 0 GGAEMO C[C@H]1C[C@H](N(C)C(=O)NCCc2cc(Br)ccc2F)CC[N@H+]1C ZINC000174362839 565630637 /nfs/dbraw/zinc/63/06/37/565630637.db2.gz HAGOJXPLKYSYHE-SWLSCSKDSA-N 1 1 386.309 3.255 10 0 GGAEMO Cc1csc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1I ZINC000191764476 565630676 /nfs/dbraw/zinc/63/06/76/565630676.db2.gz PTKARVCXFWIUBD-GHMZBOCLSA-N 1 1 392.306 3.216 10 0 GGAEMO CC[N@H+]1CCCC[C@@H]1CNC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000409677382 565632444 /nfs/dbraw/zinc/63/24/44/565632444.db2.gz AIWCOLSIPMKGFL-CZUORRHYSA-N 1 1 396.329 3.446 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)C(=O)Nc2cccc(I)c2)CC[N@H+]1C ZINC000174425842 565634735 /nfs/dbraw/zinc/63/47/35/565634735.db2.gz VAOZGKUJIOTQLC-RISCZKNCSA-N 1 1 387.265 3.238 10 0 GGAEMO CC[N@H+]1C[C@H](C)N(C(=O)N[C@@H]2CCOc3c(Br)cccc32)C[C@@H]1C ZINC000409703984 565634803 /nfs/dbraw/zinc/63/48/03/565634803.db2.gz CJWCTSJJAGOBHT-HEHGZKQESA-N 1 1 396.329 3.397 10 0 GGAEMO CCCC[N@@H+](C)CCNC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000409705970 565635549 /nfs/dbraw/zinc/63/55/49/565635549.db2.gz CSZGTWVFBOVSJV-HNNXBMFYSA-N 1 1 384.318 3.304 10 0 GGAEMO CCC[N@@H+](CC)CCNC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000409746332 565638809 /nfs/dbraw/zinc/63/88/09/565638809.db2.gz LALPFDIYUMZGRK-HNNXBMFYSA-N 1 1 384.318 3.304 10 0 GGAEMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)c2cc(C)ccc2I)C1 ZINC000174512910 565640234 /nfs/dbraw/zinc/64/02/34/565640234.db2.gz QQKGIOWNGVJSAM-ZDUSSCGKSA-N 1 1 386.277 3.013 10 0 GGAEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc(OC)c(Br)c1 ZINC000174572253 565644120 /nfs/dbraw/zinc/64/41/20/565644120.db2.gz HVDOHBSFQHTXJU-LSDHHAIUSA-N 1 1 396.329 3.226 10 0 GGAEMO COc1ccc(CNC(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1Br ZINC000174572365 565644840 /nfs/dbraw/zinc/64/48/40/565644840.db2.gz RXBKNHJNFCRNSD-GXTWGEPZSA-N 1 1 384.318 3.082 10 0 GGAEMO CC[N@H+]1CC[C@H](CNC(=O)c2cc(Br)c(Cl)cc2OC)C1 ZINC000191958097 565644967 /nfs/dbraw/zinc/64/49/67/565644967.db2.gz RSKBDYMHMYNOJY-SNVBAGLBSA-N 1 1 375.694 3.183 10 0 GGAEMO CC[N@H+]1CC[C@@H](CNC(=O)c2cc(Br)c(Cl)cc2OC)C1 ZINC000191958107 565645240 /nfs/dbraw/zinc/64/52/40/565645240.db2.gz RSKBDYMHMYNOJY-JTQLQIEISA-N 1 1 375.694 3.183 10 0 GGAEMO C[N@H+](CC(=O)OC(C)(C)C)C1CCN(Cc2cncc(Br)c2)CC1 ZINC000191980138 565647266 /nfs/dbraw/zinc/64/72/66/565647266.db2.gz YVMAAUUHHOFPII-UHFFFAOYSA-N 1 1 398.345 3.082 10 0 GGAEMO C[N@@H+](CC(=O)OC(C)(C)C)C1CCN(Cc2cncc(Br)c2)CC1 ZINC000191980138 565647270 /nfs/dbraw/zinc/64/72/70/565647270.db2.gz YVMAAUUHHOFPII-UHFFFAOYSA-N 1 1 398.345 3.082 10 0 GGAEMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000409979139 565654939 /nfs/dbraw/zinc/65/49/39/565654939.db2.gz JYSQRCQIFKDYFW-IAQYHMDHSA-N 1 1 387.268 3.213 10 0 GGAEMO C[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000409979138 565655224 /nfs/dbraw/zinc/65/52/24/565655224.db2.gz JYSQRCQIFKDYFW-ABAIWWIYSA-N 1 1 387.268 3.213 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000410053155 565661051 /nfs/dbraw/zinc/66/10/51/565661051.db2.gz RREAMVUIQODEDI-CZUORRHYSA-N 1 1 396.329 3.446 10 0 GGAEMO Cc1ccc(NC(=O)N2CCCC[C@@H]2C[NH+]2CCOCC2)cc1Br ZINC000174808431 565661273 /nfs/dbraw/zinc/66/12/73/565661273.db2.gz IKNURILVLOHSSC-MRXNPFEDSA-N 1 1 396.329 3.476 10 0 GGAEMO C[C@H]1C[N@H+]2CCC[C@H]2CN1S(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000329299963 565661917 /nfs/dbraw/zinc/66/19/17/565661917.db2.gz VHWFPNVSFPFBDZ-WFASDCNBSA-N 1 1 397.953 3.321 10 0 GGAEMO C[N@@H+](CCNC(=O)N[C@H]1CCOc2c(Br)cccc21)C1CCCC1 ZINC000410098360 565664205 /nfs/dbraw/zinc/66/42/05/565664205.db2.gz CJZRLVDKRLJJKO-INIZCTEOSA-N 1 1 396.329 3.446 10 0 GGAEMO Cn1nc(Br)cc1C(=O)N[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)cc1 ZINC000192195500 565668054 /nfs/dbraw/zinc/66/80/54/565668054.db2.gz BBRVLSQTLFZBTR-IUODEOHRSA-N 1 1 397.704 3.011 10 0 GGAEMO Cn1nc(Br)cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)cc1 ZINC000192195500 565668057 /nfs/dbraw/zinc/66/80/57/565668057.db2.gz BBRVLSQTLFZBTR-IUODEOHRSA-N 1 1 397.704 3.011 10 0 GGAEMO CC(C)c1n[nH]c(C(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1Br ZINC000174979467 565671000 /nfs/dbraw/zinc/67/10/00/565671000.db2.gz BFTHDLQAWJJEPC-OLZOCXBDSA-N 1 1 383.334 3.383 10 0 GGAEMO C[C@@]12CCC[N@@H+]1C[C@@H](c1noc(Cc3cc(F)ccc3Br)n1)OC2 ZINC000329597724 565672727 /nfs/dbraw/zinc/67/27/27/565672727.db2.gz PLPGDXFPXNNNGH-YOEHRIQHSA-N 1 1 396.260 3.488 10 0 GGAEMO C[C@@]12CCC[N@H+]1C[C@@H](c1noc(Cc3cc(F)ccc3Br)n1)OC2 ZINC000329597724 565672733 /nfs/dbraw/zinc/67/27/33/565672733.db2.gz PLPGDXFPXNNNGH-YOEHRIQHSA-N 1 1 396.260 3.488 10 0 GGAEMO C[C@]12CCC[N@@H+]1C[C@H](c1noc(Cc3cc(Br)ccc3F)n1)OC2 ZINC000329673276 565675283 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COCC[N@H+]1CCC[C@H]1CNC(=O)Nc1ccc(Br)c(C)c1F ZINC000194212654 565801512 /nfs/dbraw/zinc/80/15/12/565801512.db2.gz FFWLFPBDPFMKSB-LBPRGKRZSA-N 1 1 388.281 3.129 10 0 GGAEMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)S(=O)(=O)c1c(Cl)cccc1Br ZINC000282936394 565804047 /nfs/dbraw/zinc/80/40/47/565804047.db2.gz IJELOEHSJZOHJP-GXFFZTMASA-N 1 1 395.750 3.063 10 0 GGAEMO C[C@H]1C[C@@H](N(C)S(=O)(=O)c2c(Cl)cccc2Br)CC[N@H+]1C ZINC000282964005 565804663 /nfs/dbraw/zinc/80/46/63/565804663.db2.gz KSBOMDGOCRZBKC-QWRGUYRKSA-N 1 1 395.750 3.206 10 0 GGAEMO CC[C@H](CO)[NH+]1CCN(C(=O)Nc2cccc(Br)c2Cl)CC1 ZINC000283024387 565807556 /nfs/dbraw/zinc/80/75/56/565807556.db2.gz HXBXBUBTVLIZFN-LLVKDONJSA-N 1 1 390.709 3.023 10 0 GGAEMO CC[N@@H+](C)C[C@H]1CCN(S(=O)(=O)c2c(Cl)cccc2Br)C1 ZINC000283088131 565808163 /nfs/dbraw/zinc/80/81/63/565808163.db2.gz WILCZMIDUJNBHB-LLVKDONJSA-N 1 1 395.750 3.065 10 0 GGAEMO CSc1ccc(NC(=O)c2ccnc(N3CC[NH+](C)CC3)c2)cc1Cl ZINC000176871339 565810946 /nfs/dbraw/zinc/81/09/46/565810946.db2.gz YDJHBPBJBLVUOQ-UHFFFAOYSA-N 1 1 376.913 3.461 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1cnn(-c2ccc(Br)cc2)c1 ZINC000176979856 565819285 /nfs/dbraw/zinc/81/92/85/565819285.db2.gz XGZYWRVEBODNNZ-KRWDZBQOSA-N 1 1 391.313 3.191 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1sc(C)c(Br)c1OC ZINC000176973495 565819733 /nfs/dbraw/zinc/81/97/33/565819733.db2.gz DSXHCVCZZHJOTR-LLVKDONJSA-N 1 1 375.332 3.384 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1cc(OC)c(Br)c(OC)c1 ZINC000176995734 565821477 /nfs/dbraw/zinc/82/14/77/565821477.db2.gz OOGPBFSGWLDHHX-CYBMUJFWSA-N 1 1 385.302 3.023 10 0 GGAEMO CCOc1c(Br)cc(C(=O)N(C)C[C@@H]2CCC[N@H+]2CC)cc1OC ZINC000177006748 565821570 /nfs/dbraw/zinc/82/15/70/565821570.db2.gz UXBJMSXONZHYNN-AWEZNQCLSA-N 1 1 399.329 3.413 10 0 GGAEMO C[C@H]([NH2+][C@H]1CCOc2c(Br)cccc21)C(=O)Nc1nccs1 ZINC000283607221 565823454 /nfs/dbraw/zinc/82/34/54/565823454.db2.gz UEFRRWVWOLXAMN-CABZTGNLSA-N 1 1 382.283 3.346 10 0 GGAEMO C[C@H]([NH2+][C@@H]1CCOc2c(Br)cccc21)C(=O)Nc1nccs1 ZINC000283607227 565823989 /nfs/dbraw/zinc/82/39/89/565823989.db2.gz UEFRRWVWOLXAMN-JOYOIKCWSA-N 1 1 382.283 3.346 10 0 GGAEMO C[C@@H]1COCC[C@@H]1C(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000412966931 565824783 /nfs/dbraw/zinc/82/47/83/565824783.db2.gz FGDNZTWEBZGREH-KDOFPFPSSA-N 1 1 395.341 3.202 10 0 GGAEMO C[C@@H]1C[C@H](N(C)Cc2noc(Cc3ccc(Br)cc3)n2)CC[N@H+]1C ZINC000177058094 565825107 /nfs/dbraw/zinc/82/51/07/565825107.db2.gz IINJYCFSUMCULG-CZUORRHYSA-N 1 1 393.329 3.337 10 0 GGAEMO CC1(C)CC[C@@H](C(=O)NC2CC[NH+](Cc3cccc(Br)c3)CC2)O1 ZINC000412969407 565826020 /nfs/dbraw/zinc/82/60/20/565826020.db2.gz JMEIIGCCGHGBFB-KRWDZBQOSA-N 1 1 395.341 3.487 10 0 GGAEMO O=C(NC1CC[NH+](Cc2cccc(Br)c2)CC1)[C@@H]1CCCOCC1 ZINC000412979089 565827225 /nfs/dbraw/zinc/82/72/25/565827225.db2.gz ZAOJWIODRQXYLG-MRXNPFEDSA-N 1 1 395.341 3.346 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)Cc1ccc(F)c(Br)c1 ZINC000177137268 565831087 /nfs/dbraw/zinc/83/10/87/565831087.db2.gz MUAXOKLLKXQFFR-AWEZNQCLSA-N 1 1 380.261 3.327 10 0 GGAEMO C[N@H+]1CCC[C@H]1CNC(=O)c1ccc(COc2ccc(Br)cc2)o1 ZINC000194695510 565831418 /nfs/dbraw/zinc/83/14/18/565831418.db2.gz UPFHFOVHGQUFDV-AWEZNQCLSA-N 1 1 393.281 3.445 10 0 GGAEMO C[C@H]1COCC[C@H]1C(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000194705578 565832461 /nfs/dbraw/zinc/83/24/61/565832461.db2.gz NXDQGIFDRMMTEN-KBXCAEBGSA-N 1 1 395.341 3.202 10 0 GGAEMO Cc1nn(-c2ccc(C(=O)NC[C@@H]3CCC[N@@H+]3C)cc2)c(C)c1Br ZINC000194705338 565832622 /nfs/dbraw/zinc/83/26/22/565832622.db2.gz KWQCWZISCQWXME-INIZCTEOSA-N 1 1 391.313 3.076 10 0 GGAEMO CCCOc1c(Br)cc(C(=O)NC[C@@H]2CCC[N@H+]2C)cc1OC ZINC000194746791 565833397 /nfs/dbraw/zinc/83/33/97/565833397.db2.gz OXXVOXRFDVGXFM-ZDUSSCGKSA-N 1 1 385.302 3.071 10 0 GGAEMO C[N@@H+]1CC[C@H](N[C@@H](C(N)=O)c2cccc(Br)c2)[C@H]1c1ccccc1 ZINC000283885843 565833878 /nfs/dbraw/zinc/83/38/78/565833878.db2.gz DZQGPVYAYCWMPI-RCCFBDPRSA-N 1 1 388.309 3.011 10 0 GGAEMO C[N@H+]1CC[C@H](N[C@@H](C(N)=O)c2cccc(Br)c2)[C@H]1c1ccccc1 ZINC000283885843 565833880 /nfs/dbraw/zinc/83/38/80/565833880.db2.gz DZQGPVYAYCWMPI-RCCFBDPRSA-N 1 1 388.309 3.011 10 0 GGAEMO C[N@@H+]1CC[C@H](N[C@H](C(N)=O)c2cccc(Br)c2)[C@@H]1c1ccccc1 ZINC000283885833 565833935 /nfs/dbraw/zinc/83/39/35/565833935.db2.gz DZQGPVYAYCWMPI-BZSNNMDCSA-N 1 1 388.309 3.011 10 0 GGAEMO C[N@H+]1CC[C@H](N[C@H](C(N)=O)c2cccc(Br)c2)[C@@H]1c1ccccc1 ZINC000283885833 565833938 /nfs/dbraw/zinc/83/39/38/565833938.db2.gz DZQGPVYAYCWMPI-BZSNNMDCSA-N 1 1 388.309 3.011 10 0 GGAEMO C[C@H]1C[C@@H]1CNC(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000413128933 565835567 /nfs/dbraw/zinc/83/55/67/565835567.db2.gz DRWMZLMNTTZTSK-DZGCQCFKSA-N 1 1 380.330 3.369 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)[C@@H](C)Oc1ccccc1Br ZINC000177209464 565836053 /nfs/dbraw/zinc/83/60/53/565836053.db2.gz JRRJRZVHWQAOMD-HIFRSBDPSA-N 1 1 392.297 3.413 10 0 GGAEMO C[C@@H]1C[C@H]1CNC(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000413128934 565836226 /nfs/dbraw/zinc/83/62/26/565836226.db2.gz DRWMZLMNTTZTSK-HIFRSBDPSA-N 1 1 380.330 3.369 10 0 GGAEMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2[nH]nc3ccc(Br)cc32)C1 ZINC000177279443 565840547 /nfs/dbraw/zinc/84/05/47/565840547.db2.gz NAKYNDNAVFITEI-GFCCVEGCSA-N 1 1 379.302 3.033 10 0 GGAEMO CC(C)C[N@@H+]1CC[C@H](CNC(=O)c2n[nH]c3ccc(Br)cc32)C1 ZINC000177279443 565840551 /nfs/dbraw/zinc/84/05/51/565840551.db2.gz NAKYNDNAVFITEI-GFCCVEGCSA-N 1 1 379.302 3.033 10 0 GGAEMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2n[nH]c3ccc(Br)cc32)C1 ZINC000177279443 565840556 /nfs/dbraw/zinc/84/05/56/565840556.db2.gz NAKYNDNAVFITEI-GFCCVEGCSA-N 1 1 379.302 3.033 10 0 GGAEMO C[C@H]1CN(c2nccc3cc(Br)ccc32)CC[N@H+]1CC(C)(C)O ZINC000413253130 565841679 /nfs/dbraw/zinc/84/16/79/565841679.db2.gz YMHVHYBOJRBEFD-ZDUSSCGKSA-N 1 1 378.314 3.279 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NCc1cc(Br)ccc1OC ZINC000177451246 565851412 /nfs/dbraw/zinc/85/14/12/565851412.db2.gz RTDFMFBRHGSARR-OAHLLOKOSA-N 1 1 384.318 3.083 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)NCc1ccc(OC)c(Br)c1 ZINC000177462979 565853099 /nfs/dbraw/zinc/85/30/99/565853099.db2.gz FNOVOSJBVPGMJR-CQSZACIVSA-N 1 1 384.318 3.083 10 0 GGAEMO CCOC[C@H](C)NC(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000413467800 565853894 /nfs/dbraw/zinc/85/38/94/565853894.db2.gz HANWDLFNHPLCMD-AWEZNQCLSA-N 1 1 398.345 3.138 10 0 GGAEMO CCn1c(C)nnc1C[NH2+]C1(c2ccc(Br)cc2)CCOCC1 ZINC000195098099 565858434 /nfs/dbraw/zinc/85/84/34/565858434.db2.gz ODLYEJNABIUZIN-UHFFFAOYSA-N 1 1 379.302 3.164 10 0 GGAEMO C[C@H](O)[C@@H]1CN(c2cc(C3CC3)[nH+]c3c(Br)cccc23)CCO1 ZINC000413605368 565863068 /nfs/dbraw/zinc/86/30/68/565863068.db2.gz JXRCKIYIMRUQEP-GTNSWQLSSA-N 1 1 377.282 3.461 10 0 GGAEMO CN(C(=O)NCc1cccc(Br)c1Cl)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000413662239 565866968 /nfs/dbraw/zinc/86/69/68/565866968.db2.gz ZEMUUQVMYPNRRE-CYBMUJFWSA-N 1 1 386.721 3.481 10 0 GGAEMO C[C@@H](NC(=O)N1CC[NH+](CCCOCC(F)(F)F)CC1)c1cccs1 ZINC000195229946 565867250 /nfs/dbraw/zinc/86/72/50/565867250.db2.gz SAAFFIOTORYDCG-CYBMUJFWSA-N 1 1 379.448 3.105 10 0 GGAEMO CCCC[N@H+](Cc1ccc(Br)c(F)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000177715960 565868943 /nfs/dbraw/zinc/86/89/43/565868943.db2.gz KXDXRBNXJYGINB-CYBMUJFWSA-N 1 1 378.307 3.377 10 0 GGAEMO CCCC[N@@H+](Cc1ccc(Br)c(F)c1)[C@@H]1CCS(=O)(=O)C1 ZINC000177715960 565868946 /nfs/dbraw/zinc/86/89/46/565868946.db2.gz KXDXRBNXJYGINB-CYBMUJFWSA-N 1 1 378.307 3.377 10 0 GGAEMO CCCC[N@H+](Cc1ccc(Br)c(F)c1)[C@H]1CCS(=O)(=O)C1 ZINC000177715972 565869132 /nfs/dbraw/zinc/86/91/32/565869132.db2.gz KXDXRBNXJYGINB-ZDUSSCGKSA-N 1 1 378.307 3.377 10 0 GGAEMO CCCC[N@@H+](Cc1ccc(Br)c(F)c1)[C@H]1CCS(=O)(=O)C1 ZINC000177715972 565869135 /nfs/dbraw/zinc/86/91/35/565869135.db2.gz KXDXRBNXJYGINB-ZDUSSCGKSA-N 1 1 378.307 3.377 10 0 GGAEMO COC(=O)c1ccc(CN2CC[C@H](C[N@@H+](C)Cc3scnc3C)C2)s1 ZINC000195249215 565869817 /nfs/dbraw/zinc/86/98/17/565869817.db2.gz QCJWBHUMCXASTR-CQSZACIVSA-N 1 1 379.551 3.254 10 0 GGAEMO COC(=O)c1ccc(C[N@@H+]2CC[C@H](CN(C)Cc3scnc3C)C2)s1 ZINC000195249215 565869821 /nfs/dbraw/zinc/86/98/21/565869821.db2.gz QCJWBHUMCXASTR-CQSZACIVSA-N 1 1 379.551 3.254 10 0 GGAEMO COC(=O)c1ccc(C[N@H+]2CC[C@H](CN(C)Cc3scnc3C)C2)s1 ZINC000195249215 565869827 /nfs/dbraw/zinc/86/98/27/565869827.db2.gz QCJWBHUMCXASTR-CQSZACIVSA-N 1 1 379.551 3.254 10 0 GGAEMO Cc1cc(Br)cc(C)c1NC(=O)N1C[C@H](C)[C@H]([NH+]2CCOCC2)C1 ZINC000177760437 565871698 /nfs/dbraw/zinc/87/16/98/565871698.db2.gz FBEAZWVPAXXRKP-GOEBONIOSA-N 1 1 396.329 3.250 10 0 GGAEMO O=C(CN1CC[N@H+]2CCCC[C@@H]2C1)Nc1c(Cl)cccc1C(F)(F)F ZINC000177758936 565871755 /nfs/dbraw/zinc/87/17/55/565871755.db2.gz ZVVXOIUKKUQITB-GFCCVEGCSA-N 1 1 375.822 3.467 10 0 GGAEMO Cc1cc(Br)cc(C)c1NC(=O)N1C[C@H]([NH+]2CCOCC2)[C@@H](C)C1 ZINC000177760465 565873237 /nfs/dbraw/zinc/87/32/37/565873237.db2.gz FBEAZWVPAXXRKP-HOCLYGCPSA-N 1 1 396.329 3.250 10 0 GGAEMO Cc1csc([C@H]2CCC[N@@H+](CC(=O)N3CCC[C@H](C(F)(F)F)C3)C2)n1 ZINC000195337744 565877222 /nfs/dbraw/zinc/87/72/22/565877222.db2.gz OIHAZIKBYVFLMN-KBPBESRZSA-N 1 1 375.460 3.432 10 0 GGAEMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@@H](C)Cc2ccc(Br)cc2)C1 ZINC000177857406 565877755 /nfs/dbraw/zinc/87/77/55/565877755.db2.gz AUOTYNIUJOGYQL-HOCLYGCPSA-N 1 1 382.346 3.363 10 0 GGAEMO CN(CC1CC1)C(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000413874235 565878790 /nfs/dbraw/zinc/87/87/90/565878790.db2.gz HUDJMKYBUTYRLX-UHFFFAOYSA-N 1 1 380.330 3.465 10 0 GGAEMO CCn1cc(C2CC[NH+](CC(=O)N(C)Cc3ccc(Cl)s3)CC2)cn1 ZINC000195499703 565887462 /nfs/dbraw/zinc/88/74/62/565887462.db2.gz PKSCIJJIRSMLMS-UHFFFAOYSA-N 1 1 380.945 3.456 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)c1cc(C)ccc1I ZINC000195490456 565887525 /nfs/dbraw/zinc/88/75/25/565887525.db2.gz FXZFATPBYITNNO-LBPRGKRZSA-N 1 1 397.260 3.171 10 0 GGAEMO CCn1cc(C2CC[NH+](CC(=O)Nc3ccc(Br)cc3)CC2)cn1 ZINC000195500743 565888368 /nfs/dbraw/zinc/88/83/68/565888368.db2.gz SOFXLWDUJDXUMT-UHFFFAOYSA-N 1 1 391.313 3.484 10 0 GGAEMO CN(Cc1cc(Br)cs1)C(=O)C[NH+]1CCC(c2cc[nH]n2)CC1 ZINC000195507343 565889427 /nfs/dbraw/zinc/88/94/27/565889427.db2.gz JVSMPJLXUHNZGK-UHFFFAOYSA-N 1 1 397.342 3.072 10 0 GGAEMO COC(=O)c1cnc([C@H](C)[NH2+]CCN2CCc3c(Cl)cccc3C2)s1 ZINC000414137370 565898048 /nfs/dbraw/zinc/89/80/48/565898048.db2.gz PDEAKKPMWXXZCQ-LBPRGKRZSA-N 1 1 379.913 3.292 10 0 GGAEMO COC(=O)c1cnc([C@@H](C)[NH2+]CCN2CCc3c(Cl)cccc3C2)s1 ZINC000414137369 565898314 /nfs/dbraw/zinc/89/83/14/565898314.db2.gz PDEAKKPMWXXZCQ-GFCCVEGCSA-N 1 1 379.913 3.292 10 0 GGAEMO O=C(c1ccc(Br)cc1Br)N1CC[N@H+]2CCC[C@H]2C1 ZINC000218774084 565900845 /nfs/dbraw/zinc/90/08/45/565900845.db2.gz XGLKFOHBBVBHKH-NSHDSACASA-N 1 1 388.103 3.132 10 0 GGAEMO C[N@H+]1CCC[C@H](NC(=O)c2ccc(Br)cc2Br)C1 ZINC000218767738 565900913 /nfs/dbraw/zinc/90/09/13/565900913.db2.gz UQGUXGPVYJUDNW-JTQLQIEISA-N 1 1 376.092 3.036 10 0 GGAEMO CN(C[C@H]1CC[N@@H+](C)C1)C(=O)c1cc(Br)cc(Br)c1 ZINC000222910861 565906288 /nfs/dbraw/zinc/90/62/88/565906288.db2.gz YVEOYZSMKWQCES-JTQLQIEISA-N 1 1 390.119 3.235 10 0 GGAEMO Cc1ccc(Br)c(C[NH2+][C@H](C)c2ccc(S(N)(=O)=O)cc2)c1 ZINC000414256750 565906619 /nfs/dbraw/zinc/90/66/19/565906619.db2.gz KTMRXNUKNUAYLE-GFCCVEGCSA-N 1 1 383.311 3.256 10 0 GGAEMO Cc1nccn1C[C@H]1CCC[N@H+]1Cc1cc2c(cc1Br)OCCO2 ZINC000178287354 565910734 /nfs/dbraw/zinc/91/07/34/565910734.db2.gz IJWNXNVKCGGLCF-OAHLLOKOSA-N 1 1 392.297 3.390 10 0 GGAEMO Cc1nccn1C[C@H]1CCC[N@H+]1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000178292042 565910862 /nfs/dbraw/zinc/91/08/62/565910862.db2.gz HJDAQPBIPPDKAB-CVEARBPZSA-N 1 1 384.307 3.403 10 0 GGAEMO Cc1nccn1C[C@@H]1CCC[N@H+]1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000178292024 565910878 /nfs/dbraw/zinc/91/08/78/565910878.db2.gz HJDAQPBIPPDKAB-HOTGVXAUSA-N 1 1 384.307 3.403 10 0 GGAEMO O=C(Nc1cc(Br)ccc1N1CCCC1)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000178404097 565917172 /nfs/dbraw/zinc/91/71/72/565917172.db2.gz NQCFJEUOYPIWNB-OAHLLOKOSA-N 1 1 393.329 3.361 10 0 GGAEMO COCCC[N@H+](Cc1ccc(C(F)(F)F)c(C)c1)[C@H]1CCS(=O)(=O)C1 ZINC000414375098 565918043 /nfs/dbraw/zinc/91/80/43/565918043.db2.gz XRQRNKSKXVSPRO-HNNXBMFYSA-N 1 1 379.444 3.039 10 0 GGAEMO COCCC[N@@H+](Cc1ccc(C(F)(F)F)c(C)c1)[C@H]1CCS(=O)(=O)C1 ZINC000414375098 565918048 /nfs/dbraw/zinc/91/80/48/565918048.db2.gz XRQRNKSKXVSPRO-HNNXBMFYSA-N 1 1 379.444 3.039 10 0 GGAEMO COc1cc(S(=O)(=O)N2C[C@H]([NH+](C)C)Cc3ccccc32)ccc1Cl ZINC000414377642 565918903 /nfs/dbraw/zinc/91/89/03/565918903.db2.gz WMMZPCJZYWFXAP-CQSZACIVSA-N 1 1 380.897 3.030 10 0 GGAEMO C[N@H+]1CCC[C@H](NC(=O)c2cc(Br)sc2Br)C1 ZINC000227275778 565922008 /nfs/dbraw/zinc/92/20/08/565922008.db2.gz MIJJNURNKDIZNQ-ZETCQYMHSA-N 1 1 382.121 3.097 10 0 GGAEMO C[N@H+]1CCC[C@@H](NC(=O)c2cc(Br)sc2Br)C1 ZINC000227275770 565922104 /nfs/dbraw/zinc/92/21/04/565922104.db2.gz MIJJNURNKDIZNQ-SSDOTTSWSA-N 1 1 382.121 3.097 10 0 GGAEMO CCN(C)C(=O)C[NH2+][C@@H](C)c1ccc(Br)cc1Br ZINC000229586272 565926397 /nfs/dbraw/zinc/92/63/97/565926397.db2.gz XHNXTKQNISWZPD-VIFPVBQESA-N 1 1 378.108 3.341 10 0 GGAEMO O=C(N[C@H]1CC[N@H+]2CCCC[C@@H]12)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000229627283 565926834 /nfs/dbraw/zinc/92/68/34/565926834.db2.gz GQZIMPIZMHHBKN-PMPSAXMXSA-N 1 1 394.313 3.199 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)NCc2cc(F)ccc2Br)[C@H](C)C1 ZINC000178700055 565933935 /nfs/dbraw/zinc/93/39/35/565933935.db2.gz DYSPPHMUAUDLLA-MLGOLLRUSA-N 1 1 386.309 3.460 10 0 GGAEMO Cc1nccn1C[C@@H]1CCC[N@H+]1CC(=O)Nc1ccc(Br)cc1C ZINC000178748662 565935579 /nfs/dbraw/zinc/93/55/79/565935579.db2.gz ZJNFINPWINJKTG-INIZCTEOSA-N 1 1 391.313 3.366 10 0 GGAEMO Cc1ccc(C[N@H+]2CC[C@H](Cc3cccc(I)c3)C2)nn1 ZINC000414459124 565936671 /nfs/dbraw/zinc/93/66/71/565936671.db2.gz OEMCSERLXISGAU-OAHLLOKOSA-N 1 1 393.272 3.454 10 0 GGAEMO Cc1nccn1C[C@H]1CCC[N@H+]1CCC(=O)Nc1cccc(Br)c1 ZINC000178753964 565936960 /nfs/dbraw/zinc/93/69/60/565936960.db2.gz QLBWELXQWNNGMM-QGZVFWFLSA-N 1 1 391.313 3.447 10 0 GGAEMO CCS(=O)(=O)c1cc(Cl)cc(C[NH2+]Cc2cc(OC)ccc2OC)c1 ZINC000414477196 565940531 /nfs/dbraw/zinc/94/05/31/565940531.db2.gz BXIMBIHYBDPGKT-UHFFFAOYSA-N 1 1 383.897 3.441 10 0 GGAEMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](CCC(=O)Nc2ccccc2Br)C1 ZINC000178835743 565940620 /nfs/dbraw/zinc/94/06/20/565940620.db2.gz LHGWURQGXNDESA-ZDUSSCGKSA-N 1 1 397.313 3.441 10 0 GGAEMO CN(C)C(=O)C1([NH2+]Cc2cnc(-c3ccc(Br)cc3)s2)CC1 ZINC000414487450 565941784 /nfs/dbraw/zinc/94/17/84/565941784.db2.gz OUWNVOWGGAJZAN-UHFFFAOYSA-N 1 1 380.311 3.283 10 0 GGAEMO CN(C)C(=O)[C@H]1CC[N@@H+](Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000414503160 565943037 /nfs/dbraw/zinc/94/30/37/565943037.db2.gz VTQXBRDVUOZHIR-ZDUSSCGKSA-N 1 1 394.338 3.483 10 0 GGAEMO Cn1cc[nH+]c1CC1CCN(C(=O)NCc2sccc2Br)CC1 ZINC000178884090 565944315 /nfs/dbraw/zinc/94/43/15/565944315.db2.gz DOROEFIWHJEEJJ-UHFFFAOYSA-N 1 1 397.342 3.408 10 0 GGAEMO COc1cc(-c2noc([C@H]3CC[N@@H+](C)[C@@H](C)C3)n2)cc(Br)c1O ZINC000351235811 565947502 /nfs/dbraw/zinc/94/75/02/565947502.db2.gz YTUYBVBOSZAQOU-UWVGGRQHSA-N 1 1 382.258 3.411 10 0 GGAEMO CCOc1cc(C[N@@H+](C[C@@H]2CCC(=O)N2)C(C)C)cc(Br)c1OC ZINC000414554597 565948068 /nfs/dbraw/zinc/94/80/68/565948068.db2.gz HFJMRVKGYADKTR-AWEZNQCLSA-N 1 1 399.329 3.345 10 0 GGAEMO CCOc1c(Br)cc(C[N@@H+](C[C@@H]2CCC(=O)N2)C(C)C)cc1OC ZINC000414555494 565948234 /nfs/dbraw/zinc/94/82/34/565948234.db2.gz IKBLTTXHKJSARI-AWEZNQCLSA-N 1 1 399.329 3.345 10 0 GGAEMO COc1ccc(Cl)c(S(=O)(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)c1 ZINC000178949705 565948525 /nfs/dbraw/zinc/94/85/25/565948525.db2.gz KDFQBFXUVVCKLW-AEFFLSMTSA-N 1 1 380.897 3.072 10 0 GGAEMO COc1ccc(Cl)c(S(=O)(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c1 ZINC000178949705 565948530 /nfs/dbraw/zinc/94/85/30/565948530.db2.gz KDFQBFXUVVCKLW-AEFFLSMTSA-N 1 1 380.897 3.072 10 0 GGAEMO CNC(=O)[C@@H]([NH2+]Cc1csc(-c2cccc(Br)c2)n1)C(C)C ZINC000178950774 565948647 /nfs/dbraw/zinc/94/86/47/565948647.db2.gz PSBIXQKEROZQKT-AWEZNQCLSA-N 1 1 382.327 3.433 10 0 GGAEMO CC(C)[N@H+](Cc1cnn(-c2ccc(Br)cc2)c1)C[C@H]1CCC(=O)N1 ZINC000414556623 565948760 /nfs/dbraw/zinc/94/87/60/565948760.db2.gz KJKAFDIFMZJRIO-MRXNPFEDSA-N 1 1 391.313 3.124 10 0 GGAEMO COC(=O)[C@@H]1CSCC[N@@H+](CC2=Cc3cc(Br)ccc3OC2)C1 ZINC000414570499 565949245 /nfs/dbraw/zinc/94/92/45/565949245.db2.gz ROSXNEAMIJDFEP-AWEZNQCLSA-N 1 1 398.322 3.063 10 0 GGAEMO COC(=O)[C@H]1CSCC[N@@H+](Cc2cnc(-c3c(F)cccc3F)s2)C1 ZINC000414578022 565949793 /nfs/dbraw/zinc/94/97/93/565949793.db2.gz HYKUUSMZLFLEEC-LLVKDONJSA-N 1 1 384.473 3.426 10 0 GGAEMO COC(=O)[C@H]1CSCC[N@H+](Cc2ccnc3c(Br)cccc23)C1 ZINC000414595951 565951398 /nfs/dbraw/zinc/95/13/98/565951398.db2.gz TZZVFNIXGAOREP-CYBMUJFWSA-N 1 1 395.322 3.335 10 0 GGAEMO COC(=O)[C@H]1CSCC[N@@H+](Cc2ccnc3c(Br)cccc23)C1 ZINC000414595951 565951401 /nfs/dbraw/zinc/95/14/01/565951401.db2.gz TZZVFNIXGAOREP-CYBMUJFWSA-N 1 1 395.322 3.335 10 0 GGAEMO CCc1c(NC(=O)[C@H]2CC[C@@H]([NH3+])C2)[nH]nc1-c1ccc(Br)cc1 ZINC000237118591 565951791 /nfs/dbraw/zinc/95/17/91/565951791.db2.gz ZRCLFNVNUKBLTE-WCQYABFASA-N 1 1 377.286 3.468 10 0 GGAEMO Cc1cc(N2CCC[C@H]([NH2+]Cc3ccc(C)cc3Br)C2=O)n(C)n1 ZINC000179011804 565951974 /nfs/dbraw/zinc/95/19/74/565951974.db2.gz CNGUNJXMDZGPFP-INIZCTEOSA-N 1 1 391.313 3.085 10 0 GGAEMO Cc1cnc(CCN(C)C(=O)NC[C@@H](C)[N@@H+]2CCc3sccc3C2)s1 ZINC000179095272 565957923 /nfs/dbraw/zinc/95/79/23/565957923.db2.gz SRIGEEISWSZDOV-CYBMUJFWSA-N 1 1 378.567 3.144 10 0 GGAEMO Cc1cnc(CCN(C)C(=O)NC[C@@H](C)[N@H+]2CCc3sccc3C2)s1 ZINC000179095272 565957927 /nfs/dbraw/zinc/95/79/27/565957927.db2.gz SRIGEEISWSZDOV-CYBMUJFWSA-N 1 1 378.567 3.144 10 0 GGAEMO C[C@@H]([NH2+][C@H]1COc2c1ccc(Cl)c2Cl)c1cccc(S(N)(=O)=O)c1 ZINC000360808640 565961873 /nfs/dbraw/zinc/96/18/73/565961873.db2.gz AKXQJXMFFXHGNT-OTYXRUKQSA-N 1 1 387.288 3.425 10 0 GGAEMO [NH3+][C@@H](CNCc1cc(Br)c2c(c1)OCCCO2)c1ccccc1 ZINC000414832798 565962003 /nfs/dbraw/zinc/96/20/03/565962003.db2.gz OYAKLPJFABQEGB-INIZCTEOSA-N 1 1 377.282 3.400 10 0 GGAEMO C[C@H](CC(=O)Nc1ccc(Br)cc1)NC[C@H]([NH3+])c1ccccc1 ZINC000414825495 565962229 /nfs/dbraw/zinc/96/22/29/565962229.db2.gz CICIZKZVOUDGCM-DYVFJYSZSA-N 1 1 376.298 3.456 10 0 GGAEMO C[C@H]([NH2+][C@@H]1COc2c1ccc(Cl)c2Cl)c1cccc(S(N)(=O)=O)c1 ZINC000360808639 565962330 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COCC[N@H+]1CCN(CCCc2ccc(Br)cc2OC)C[C@H]1C ZINC000181817735 566167319 /nfs/dbraw/zinc/16/73/19/566167319.db2.gz JTHWHXMICGTCKC-OAHLLOKOSA-N 1 1 385.346 3.043 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CN1CCN(CCCc2ccccc2Br)CC1 ZINC000181861457 566169221 /nfs/dbraw/zinc/16/92/21/566169221.db2.gz WDNZFTRCPRMZRV-IBGZPJMESA-N 1 1 394.401 3.484 10 0 GGAEMO O=C1C[C@]2(CC[N@@H+](Cc3csc(COc4ccc(Cl)cc4)n3)C2)CN1 ZINC000366886903 566174886 /nfs/dbraw/zinc/17/48/86/566174886.db2.gz PIKLQWGSZPXIMR-GOSISDBHSA-N 1 1 377.897 3.088 10 0 GGAEMO O=C1C[C@]2(CC[N@H+](Cc3csc(COc4ccc(Cl)cc4)n3)C2)CN1 ZINC000366886903 566174890 /nfs/dbraw/zinc/17/48/90/566174890.db2.gz PIKLQWGSZPXIMR-GOSISDBHSA-N 1 1 377.897 3.088 10 0 GGAEMO COc1cc(Br)ccc1C[N@@H+](CCC(N)=O)Cc1ccccc1 ZINC000182067155 566180338 /nfs/dbraw/zinc/18/03/38/566180338.db2.gz OAKJCFAUMAPSGP-UHFFFAOYSA-N 1 1 377.282 3.335 10 0 GGAEMO CNC(=O)c1ccc(C[N@H+](C)Cc2ccc(Br)cc2OC)cc1 ZINC000182062733 566180532 /nfs/dbraw/zinc/18/05/32/566180532.db2.gz 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COC(=O)Cc1ccc(C[NH2+]Cc2ccc(OC)c(O)c2Br)cc1 ZINC000600186902 566323073 /nfs/dbraw/zinc/32/30/73/566323073.db2.gz KRQCWZGDRPOGRP-UHFFFAOYSA-N 1 1 394.265 3.169 10 0 GGAEMO Brc1ccc([C@@H]2CCCN2c2cc[nH+]c(N3CCOCC3)n2)cc1 ZINC000576197665 566324559 /nfs/dbraw/zinc/32/45/59/566324559.db2.gz NOBVAIHZQMIGMW-INIZCTEOSA-N 1 1 389.297 3.417 10 0 GGAEMO Cc1sc(NC(=O)C[N@@H+](C)CC2(CO)CC2)nc1-c1ccc(Cl)cc1 ZINC000446062242 566326157 /nfs/dbraw/zinc/32/61/57/566326157.db2.gz MWLSVFVXOXAPPL-UHFFFAOYSA-N 1 1 379.913 3.415 10 0 GGAEMO Cc1sc(NC(=O)C[N@H+](C)CC2(CO)CC2)nc1-c1ccc(Cl)cc1 ZINC000446062242 566326165 /nfs/dbraw/zinc/32/61/65/566326165.db2.gz MWLSVFVXOXAPPL-UHFFFAOYSA-N 1 1 379.913 3.415 10 0 GGAEMO CN(C[C@@H]1CCC[N@H+]1C)C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000420875532 566327120 /nfs/dbraw/zinc/32/71/20/566327120.db2.gz ZTFWBCXLDOYXAK-SWLSCSKDSA-N 1 1 382.302 3.008 10 0 GGAEMO COC[C@@H]1CCC[N@H+]([C@H]2CCc3cc(Br)ccc3NC2=O)CC1 ZINC000625466082 566327837 /nfs/dbraw/zinc/32/78/37/566327837.db2.gz WIYAEEFXCUKAME-DYVFJYSZSA-N 1 1 381.314 3.451 10 0 GGAEMO C[N@H+]1CCC[C@@]2(CCN(C(=O)[C@H]3CCc4cc(Br)ccc43)C2)C1 ZINC000648914752 566328564 /nfs/dbraw/zinc/32/85/64/566328564.db2.gz UJJDDIRMIYVVQK-PKOBYXMFSA-N 1 1 377.326 3.423 10 0 GGAEMO CCOC[C@H](C)CS(=O)(=O)N[C@@H](C[NH+](C)C)c1ccc(Cl)c(Cl)c1 ZINC000625535902 566331338 /nfs/dbraw/zinc/33/13/38/566331338.db2.gz WMNSGYZPZJAAOB-LRDDRELGSA-N 1 1 397.368 3.188 10 0 GGAEMO Cc1cc(CS(=O)(=O)N[C@@H](C[NH+](C)C)c2ccc(Cl)c(Cl)c2)on1 ZINC000625535400 566331716 /nfs/dbraw/zinc/33/17/16/566331716.db2.gz PTATXLJHTMVPCR-HNNXBMFYSA-N 1 1 392.308 3.012 10 0 GGAEMO C[NH+](C)C[C@@H](NS(=O)(=O)C[C@H]1CCCCO1)c1ccc(Cl)c(Cl)c1 ZINC000625535742 566331754 /nfs/dbraw/zinc/33/17/54/566331754.db2.gz UVZQICVHQZVMTK-CZUORRHYSA-N 1 1 395.352 3.085 10 0 GGAEMO Cc1cc(CS(=O)(=O)N[C@@H](C[NH+](C)C)c2ccc(Cl)c(Cl)c2)no1 ZINC000625535715 566332779 /nfs/dbraw/zinc/33/27/79/566332779.db2.gz UBKMAABSXCLJGL-HNNXBMFYSA-N 1 1 392.308 3.012 10 0 GGAEMO CC(C)[N@@H+](Cc1csc(-c2cccc(Br)c2)n1)C[C@@H](O)CO ZINC000421007117 566335070 /nfs/dbraw/zinc/33/50/70/566335070.db2.gz XBJWGXPZLCSQHE-OAHLLOKOSA-N 1 1 385.327 3.136 10 0 GGAEMO CC(C)[N@H+](Cc1csc(-c2cccc(Br)c2)n1)C[C@@H](O)CO ZINC000421007117 566335078 /nfs/dbraw/zinc/33/50/78/566335078.db2.gz XBJWGXPZLCSQHE-OAHLLOKOSA-N 1 1 385.327 3.136 10 0 GGAEMO C[C@@H]1CC[C@@H](O)C[N@@H+]1Cc1coc(-c2ccc(I)cc2)n1 ZINC000420999872 566335154 /nfs/dbraw/zinc/33/51/54/566335154.db2.gz CDFWUQGLQPSINB-IAQYHMDHSA-N 1 1 398.244 3.291 10 0 GGAEMO C[C@@H]1CC[C@@H](O)C[N@H+]1Cc1coc(-c2ccc(I)cc2)n1 ZINC000420999872 566335160 /nfs/dbraw/zinc/33/51/60/566335160.db2.gz CDFWUQGLQPSINB-IAQYHMDHSA-N 1 1 398.244 3.291 10 0 GGAEMO OCC[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3Br)o2)CC1 ZINC000421033645 566335527 /nfs/dbraw/zinc/33/55/27/566335527.db2.gz GGIZEAYIKPPNGG-CYBMUJFWSA-N 1 1 380.286 3.484 10 0 GGAEMO CC[NH+]1CCN(CCCCNC(=O)c2sc3ncccc3c2Cl)CC1 ZINC000625553264 566336135 /nfs/dbraw/zinc/33/61/35/566336135.db2.gz FQIPEGGCLGHTDH-UHFFFAOYSA-N 1 1 380.945 3.097 10 0 GGAEMO COC(=O)c1cc(C[NH2+][C@@](C)(CO)c2ccc(Br)cc2)c(C)o1 ZINC000556830709 566336140 /nfs/dbraw/zinc/33/61/40/566336140.db2.gz ITGSYGUIFPPDCF-KRWDZBQOSA-N 1 1 382.254 3.134 10 0 GGAEMO C[N@@H+](CCCCO)CCOc1c(Br)cccc1Br ZINC000482855769 566339656 /nfs/dbraw/zinc/33/96/56/566339656.db2.gz JBCCNMMRZCUFQI-UHFFFAOYSA-N 1 1 381.108 3.295 10 0 GGAEMO C[C@@H](NC1CC[NH+](CCC(=O)N(C)C)CC1)c1ccc(Br)s1 ZINC000482886400 566340945 /nfs/dbraw/zinc/34/09/45/566340945.db2.gz GPOAVPYMAOWUDR-GFCCVEGCSA-N 1 1 388.375 3.104 10 0 GGAEMO C[N@H+]1C[C@@H](CNC(=O)Cc2cccc(Br)c2)[C@H](c2ccccc2)C1 ZINC000649100985 566343741 /nfs/dbraw/zinc/34/37/41/566343741.db2.gz HHXNKIHKUHRYMB-MJGOQNOKSA-N 1 1 387.321 3.453 10 0 GGAEMO CNS(=O)(=O)[C@H]1CCC[N@H+](C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000576433145 566345085 /nfs/dbraw/zinc/34/50/85/566345085.db2.gz YCRWZWMHKJYNPG-OVHOFWQVSA-N 1 1 376.444 3.122 10 0 GGAEMO CNS(=O)(=O)[C@H]1CCC[N@@H+](C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000576433145 566345089 /nfs/dbraw/zinc/34/50/89/566345089.db2.gz YCRWZWMHKJYNPG-OVHOFWQVSA-N 1 1 376.444 3.122 10 0 GGAEMO C[C@H]([NH2+]CC(=O)Nc1nc2c(s1)CCCC2)c1ccc(Br)cn1 ZINC000482964738 566345712 /nfs/dbraw/zinc/34/57/12/566345712.db2.gz SPMVMKPYFVTMEV-JTQLQIEISA-N 1 1 395.326 3.469 10 0 GGAEMO COc1c(Br)cc(CN[C@H]2CC[NH2+]C[C@@H]2C)cc1Br ZINC000556939384 566347922 /nfs/dbraw/zinc/34/79/22/566347922.db2.gz YISMDBBALDIEPC-ZANVPECISA-N 1 1 392.135 3.308 10 0 GGAEMO COC(=O)c1cc(C[NH2+]Cc2cc(OC)ccc2Br)n(C)c1C ZINC000462779710 566351422 /nfs/dbraw/zinc/35/14/22/566351422.db2.gz UDOXEKTZAAMEGC-UHFFFAOYSA-N 1 1 381.270 3.181 10 0 GGAEMO C[C@H](C[N@H+]1CC[C@H](Sc2ccc(Br)cc2)C1)CS(C)(=O)=O ZINC000625703370 566351548 /nfs/dbraw/zinc/35/15/48/566351548.db2.gz FXGOKCMRRSMNLX-DOMZBBRYSA-N 1 1 392.384 3.296 10 0 GGAEMO Brc1cc2c(c(C[N@@H+]3CCCC[C@@H]3CN3CCOCC3)c1)OCC2 ZINC000462787809 566352932 /nfs/dbraw/zinc/35/29/32/566352932.db2.gz DLXNYYVGUCNPQH-GOSISDBHSA-N 1 1 395.341 3.071 10 0 GGAEMO Brc1cc2c(c(C[N@H+]3CCCC[C@@H]3CN3CCOCC3)c1)OCC2 ZINC000462787809 566352935 /nfs/dbraw/zinc/35/29/35/566352935.db2.gz DLXNYYVGUCNPQH-GOSISDBHSA-N 1 1 395.341 3.071 10 0 GGAEMO Brc1cc2c(c(CN3CCCC[C@@H]3C[NH+]3CCOCC3)c1)OCC2 ZINC000462787809 566352939 /nfs/dbraw/zinc/35/29/39/566352939.db2.gz DLXNYYVGUCNPQH-GOSISDBHSA-N 1 1 395.341 3.071 10 0 GGAEMO CC[N@H+]1CCC[C@H](Nc2ncnc3ccc(I)cc32)C1 ZINC000462789341 566353190 /nfs/dbraw/zinc/35/31/90/566353190.db2.gz KSRFAPXEPSANHI-LBPRGKRZSA-N 1 1 382.249 3.131 10 0 GGAEMO C[C@@H](NC(=O)c1ccc2scc(Br)c2c1)[C@H]1C[N@H+](C)CCO1 ZINC000649200459 566353416 /nfs/dbraw/zinc/35/34/16/566353416.db2.gz RRKXSPZXCIRSMA-QMTHXVAHSA-N 1 1 383.311 3.113 10 0 GGAEMO C[C@@H](NC(=O)c1ccc2scc(Br)c2c1)[C@H]1C[N@@H+](C)CCO1 ZINC000649200459 566353422 /nfs/dbraw/zinc/35/34/22/566353422.db2.gz RRKXSPZXCIRSMA-QMTHXVAHSA-N 1 1 383.311 3.113 10 0 GGAEMO CCn1c(CNC(=O)[C@H]2CCCC[N@H+]2CC)nc2cc(Br)ccc21 ZINC000483053013 566355054 /nfs/dbraw/zinc/35/50/54/566355054.db2.gz VEFHDTVKQWRNAG-MRXNPFEDSA-N 1 1 393.329 3.309 10 0 GGAEMO Cc1cc(C(F)(F)F)ccc1C[N@@H+]1CCCN(S(=O)(=O)C2CC2)CC1 ZINC000670273118 566355782 /nfs/dbraw/zinc/35/57/82/566355782.db2.gz ZVRAVOLWCXLEAJ-UHFFFAOYSA-N 1 1 376.444 3.014 10 0 GGAEMO Cc1cc(C(F)(F)F)ccc1C[N@H+]1CCCN(S(=O)(=O)C2CC2)CC1 ZINC000670273118 566355791 /nfs/dbraw/zinc/35/57/91/566355791.db2.gz ZVRAVOLWCXLEAJ-UHFFFAOYSA-N 1 1 376.444 3.014 10 0 GGAEMO CC(C)[C@H](CNC(=O)[C@H](C)Oc1ccc(Cl)cc1Cl)[NH+]1CCOCC1 ZINC000649235384 566355912 /nfs/dbraw/zinc/35/59/12/566355912.db2.gz OYSGKPAQGQGTIB-BBRMVZONSA-N 1 1 389.323 3.234 10 0 GGAEMO C[N@H+]1CC[C@H](NS(=O)(=O)CCc2cccc(Cl)c2)[C@H]1c1ccccc1 ZINC000510021037 566356645 /nfs/dbraw/zinc/35/66/45/566356645.db2.gz PRJCGARHEDZFJC-RBUKOAKNSA-N 1 1 378.925 3.247 10 0 GGAEMO CN(Cc1cc(Br)cs1)C(=O)C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000625773733 566357396 /nfs/dbraw/zinc/35/73/96/566357396.db2.gz MLCCTROKFWDNPZ-OLZOCXBDSA-N 1 1 389.384 3.439 10 0 GGAEMO O[C@@H](COc1cc(F)cc(Br)c1)C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000625777183 566357439 /nfs/dbraw/zinc/35/74/39/566357439.db2.gz BVZNZHVYUHJESH-BMFZPTHFSA-N 1 1 390.318 3.298 10 0 GGAEMO C[N@H+](Cc1nc2cc(Br)ccc2[nH]1)[C@H](CC(N)=O)c1ccccc1 ZINC000483112398 566358248 /nfs/dbraw/zinc/35/82/48/566358248.db2.gz SDDYNHSOJPHHTB-MRXNPFEDSA-N 1 1 387.281 3.374 10 0 GGAEMO C[N@@H+](Cc1nc2cc(Br)ccc2[nH]1)[C@H](CC(N)=O)c1ccccc1 ZINC000483112398 566358251 /nfs/dbraw/zinc/35/82/51/566358251.db2.gz SDDYNHSOJPHHTB-MRXNPFEDSA-N 1 1 387.281 3.374 10 0 GGAEMO COc1cc(Br)ccc1[C@@H]1CCCN1C[C@H](O)C[N@@H+](C)C1CC1 ZINC000625794392 566358659 /nfs/dbraw/zinc/35/86/59/566358659.db2.gz JJCMKUZSPSNYMJ-WBVHZDCISA-N 1 1 383.330 3.050 10 0 GGAEMO CCCCc1noc(C[NH2+][C@@]2(CO)CCc3cc(Br)ccc3C2)n1 ZINC000625795627 566359247 /nfs/dbraw/zinc/35/92/47/566359247.db2.gz XVYILOURTIMVPH-SFHVURJKSA-N 1 1 394.313 3.184 10 0 GGAEMO COc1ccc(Br)cc1[C@H]1CCCN1C(=O)C[N@H+]1CC[C@H](C)C1 ZINC000576595850 566360746 /nfs/dbraw/zinc/36/07/46/566360746.db2.gz PZSBDDYPPIBNET-XJKSGUPXSA-N 1 1 381.314 3.463 10 0 GGAEMO CC(C)(CO)[NH+]1CCN(C(=O)c2ccc3scc(Br)c3c2)CC1 ZINC000649313891 566361722 /nfs/dbraw/zinc/36/17/22/566361722.db2.gz MLGZPHFEXSCRTR-UHFFFAOYSA-N 1 1 397.338 3.193 10 0 GGAEMO COc1cc(C[N@@H+]2CC[C@@H](O)C2(C)C)cc(Br)c1OC(F)F ZINC000462870275 566362743 /nfs/dbraw/zinc/36/27/43/566362743.db2.gz JGJXKICRZFPFDF-GFCCVEGCSA-N 1 1 380.229 3.404 10 0 GGAEMO COc1cc(C[N@H+]2CC[C@@H](O)C2(C)C)cc(Br)c1OC(F)F ZINC000462870275 566362744 /nfs/dbraw/zinc/36/27/44/566362744.db2.gz JGJXKICRZFPFDF-GFCCVEGCSA-N 1 1 380.229 3.404 10 0 GGAEMO O=C(c1ccc(Br)c(C(F)(F)F)c1)N1CC[NH2+]C[C@H]1C(F)F ZINC000649362643 566363433 /nfs/dbraw/zinc/36/34/33/566363433.db2.gz JSMIKQCZKPSRBJ-JTQLQIEISA-N 1 1 387.146 3.147 10 0 GGAEMO Cc1c(Cl)c(C[NH2+]C[C@@H](c2ccccc2Cl)N2CCOCC2)nn1C ZINC000421323714 566365005 /nfs/dbraw/zinc/36/50/05/566365005.db2.gz GZJYUEKIDHAKLT-KRWDZBQOSA-N 1 1 383.323 3.198 10 0 GGAEMO O=C(Cc1ccc(Br)s1)N1CC[NH+](CCc2ccccc2)CC1 ZINC000510115319 566365259 /nfs/dbraw/zinc/36/52/59/566365259.db2.gz BPWJQQZTIRMQNR-UHFFFAOYSA-N 1 1 393.350 3.440 10 0 GGAEMO CN([C@@H]1CC[N@@H+](C2CC2)C1)S(=O)(=O)c1cc(C(F)(F)F)ccc1Cl ZINC000600782893 566366000 /nfs/dbraw/zinc/36/60/00/566366000.db2.gz IBMOFKPAZUMQQD-GFCCVEGCSA-N 1 1 382.835 3.216 10 0 GGAEMO CN([C@@H]1CC[N@H+](C2CC2)C1)S(=O)(=O)c1cc(C(F)(F)F)ccc1Cl ZINC000600782893 566366007 /nfs/dbraw/zinc/36/60/07/566366007.db2.gz IBMOFKPAZUMQQD-GFCCVEGCSA-N 1 1 382.835 3.216 10 0 GGAEMO Cc1c(Cl)c(C[NH2+]C[C@H](CO)Cc2ccccc2Br)nn1C ZINC000421348811 566365979 /nfs/dbraw/zinc/36/59/79/566365979.db2.gz BTEJOQWAOVMMEA-GFCCVEGCSA-N 1 1 386.721 3.085 10 0 GGAEMO Cc1ccc(C[N@@H+](CCO)CCC(=O)Nc2cccc(Br)c2)o1 ZINC000483225297 566366119 /nfs/dbraw/zinc/36/61/19/566366119.db2.gz GNWVKGGUIWHODN-UHFFFAOYSA-N 1 1 381.270 3.174 10 0 GGAEMO Cc1c(Cl)c(C[NH2+]C[C@@H](CO)Cc2ccccc2C(F)(F)F)nn1C ZINC000421342151 566366210 /nfs/dbraw/zinc/36/62/10/566366210.db2.gz MVPSNUGMTYANOH-LBPRGKRZSA-N 1 1 375.822 3.342 10 0 GGAEMO C[N@@H+](CCCNC(=O)C(=O)c1ccc(Br)cc1)Cc1ccccc1 ZINC000510135609 566366744 /nfs/dbraw/zinc/36/67/44/566366744.db2.gz PCNSJYYYMYHIPY-UHFFFAOYSA-N 1 1 389.293 3.270 10 0 GGAEMO Cc1c(Cl)c(C[NH2+]C[C@H](c2ccc(Cl)cc2)N2CCOCC2)nn1C ZINC000421327433 566366729 /nfs/dbraw/zinc/36/67/29/566366729.db2.gz QFQDZSGZHOQYNQ-QGZVFWFLSA-N 1 1 383.323 3.198 10 0 GGAEMO Cc1c(Cl)c(C[NH2+]C[C@@H](c2cccc(Cl)c2)N2CCOCC2)nn1C ZINC000421331023 566366753 /nfs/dbraw/zinc/36/67/53/566366753.db2.gz ZDUVYWOKEAIUBI-KRWDZBQOSA-N 1 1 383.323 3.198 10 0 GGAEMO CNC(=O)[C@H]1CC[N@@H+](Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000421373225 566367599 /nfs/dbraw/zinc/36/75/99/566367599.db2.gz DSEMMGVOTPNXGI-LBPRGKRZSA-N 1 1 380.311 3.141 10 0 GGAEMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)C1 ZINC000625905344 566368767 /nfs/dbraw/zinc/36/87/67/566368767.db2.gz REELWUMJEWCTDA-LGRHPFTQSA-N 1 1 377.326 3.135 10 0 GGAEMO CC(C)(CNc1cc[nH+]c2cc(Br)ccc12)N1CCS(=O)CC1 ZINC000446858052 566369459 /nfs/dbraw/zinc/36/94/59/566369459.db2.gz YGLXCARDYIGTHP-UHFFFAOYSA-N 1 1 396.354 3.252 10 0 GGAEMO C[C@@H]1OCC[C@@H]1[N@H+](CCO)Cc1ncc(-c2ccccc2Br)o1 ZINC000483268639 566369708 /nfs/dbraw/zinc/36/97/08/566369708.db2.gz PANQCMZTBUNEAP-WFASDCNBSA-N 1 1 381.270 3.076 10 0 GGAEMO C[C@@H]1OCC[C@@H]1[N@@H+](CCO)Cc1ncc(-c2ccccc2Br)o1 ZINC000483268639 566369714 /nfs/dbraw/zinc/36/97/14/566369714.db2.gz PANQCMZTBUNEAP-WFASDCNBSA-N 1 1 381.270 3.076 10 0 GGAEMO O=C(NC[C@@H](c1ccco1)[NH+]1CCCCC1)c1nscc1Br ZINC000649512518 566369755 /nfs/dbraw/zinc/36/97/55/566369755.db2.gz KFWKMPNMNYATGJ-LBPRGKRZSA-N 1 1 384.299 3.456 10 0 GGAEMO O=C(NC[C@H](c1ccco1)[NH+]1CCCCC1)c1nscc1Br ZINC000649512517 566370054 /nfs/dbraw/zinc/37/00/54/566370054.db2.gz KFWKMPNMNYATGJ-GFCCVEGCSA-N 1 1 384.299 3.456 10 0 GGAEMO C[C@H]1OCC[C@@H]1[N@H+](CCO)Cc1coc(-c2ccc(Br)cc2)n1 ZINC000483290994 566370478 /nfs/dbraw/zinc/37/04/78/566370478.db2.gz JAEZPKBHCSLUCV-WBMJQRKESA-N 1 1 381.270 3.076 10 0 GGAEMO C[C@H]1OCC[C@@H]1[N@@H+](CCO)Cc1coc(-c2ccc(Br)cc2)n1 ZINC000483290994 566370484 /nfs/dbraw/zinc/37/04/84/566370484.db2.gz JAEZPKBHCSLUCV-WBMJQRKESA-N 1 1 381.270 3.076 10 0 GGAEMO CNC(=O)[C@@H]1CC[N@H+](Cc2cc(Br)c(C)c(Br)c2)C1 ZINC000421385510 566370880 /nfs/dbraw/zinc/37/08/80/566370880.db2.gz GQCMJRAQNJFZIJ-LLVKDONJSA-N 1 1 390.119 3.088 10 0 GGAEMO CNC(=O)[C@@H]1CC[N@@H+](Cc2cc(Br)c(C)c(Br)c2)C1 ZINC000421385510 566370886 /nfs/dbraw/zinc/37/08/86/566370886.db2.gz GQCMJRAQNJFZIJ-LLVKDONJSA-N 1 1 390.119 3.088 10 0 GGAEMO CCCOc1c(Br)cc(C[N@H+]2CC[C@@H](C(=O)NC)C2)cc1OCC ZINC000421386951 566371046 /nfs/dbraw/zinc/37/10/46/566371046.db2.gz OLGWTMUXTKDVCI-CQSZACIVSA-N 1 1 399.329 3.205 10 0 GGAEMO C[C@@H]1OCC[C@H]1[N@H+](CCO)CC(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000483294052 566371731 /nfs/dbraw/zinc/37/17/31/566371731.db2.gz HOEUHGLCENDWCM-LKFCYVNXSA-N 1 1 381.687 3.057 10 0 GGAEMO C[C@@H]1OCC[C@H]1[N@@H+](CCO)CC(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000483294052 566371736 /nfs/dbraw/zinc/37/17/36/566371736.db2.gz HOEUHGLCENDWCM-LKFCYVNXSA-N 1 1 381.687 3.057 10 0 GGAEMO C[NH+](C)C[C@@H](NCC(=O)NC(C1CC1)C1CC1)c1ccc(Cl)c(Cl)c1 ZINC000625983705 566372117 /nfs/dbraw/zinc/37/21/17/566372117.db2.gz YGUAKGSLAWYPCP-QGZVFWFLSA-N 1 1 384.351 3.491 10 0 GGAEMO Brc1cccc(C2([NH2+]Cc3cc4n(n3)CCC4)CCOCC2)c1 ZINC000649555796 566373515 /nfs/dbraw/zinc/37/35/15/566373515.db2.gz XHLNZPVYFMTMCV-UHFFFAOYSA-N 1 1 376.298 3.387 10 0 GGAEMO Cc1cc(C)c(C[S@@](=O)Cc2cc(=O)n3cc(Cl)ccc3n2)c(C)[nH+]1 ZINC000600898956 566373848 /nfs/dbraw/zinc/37/38/48/566373848.db2.gz DEEZCOVWVNNUBD-VWLOTQADSA-N 1 1 375.881 3.117 10 0 GGAEMO Cc1cc(C(=O)N[C@@H](C)C[N@@H+](C)C(C)C)nn1-c1ccc(Br)cc1 ZINC000576750074 566373939 /nfs/dbraw/zinc/37/39/39/566373939.db2.gz RAVWOZGSODGDIY-ZDUSSCGKSA-N 1 1 393.329 3.402 10 0 GGAEMO O[C@@H](Cn1cccn1)C[N@@H+]1CCC[C@H]1c1ccc(Br)cc1Cl ZINC000626008793 566374114 /nfs/dbraw/zinc/37/41/14/566374114.db2.gz LWYXFKMGZSIFBR-CJNGLKHVSA-N 1 1 384.705 3.497 10 0 GGAEMO O[C@@H](Cn1cccn1)C[N@H+]1CCC[C@H]1c1ccc(Br)cc1Cl ZINC000626008793 566374121 /nfs/dbraw/zinc/37/41/21/566374121.db2.gz LWYXFKMGZSIFBR-CJNGLKHVSA-N 1 1 384.705 3.497 10 0 GGAEMO Cc1cc(Br)ccc1[C@H]1CCC[N@H+]1C[C@@H](O)COC1CCOCC1 ZINC000626009253 566374728 /nfs/dbraw/zinc/37/47/28/566374728.db2.gz CBSFCJVVQXSOFZ-VQIMIIECSA-N 1 1 398.341 3.451 10 0 GGAEMO Cc1cnc([C@H]([NH2+]Cc2ccc(S(=O)(=O)NC3CC3)cc2)C2CC2)s1 ZINC000649583707 566374863 /nfs/dbraw/zinc/37/48/63/566374863.db2.gz WUCKQAICYQNZKZ-QGZVFWFLSA-N 1 1 377.535 3.133 10 0 GGAEMO C[C@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccc(S(=O)(=O)NC2CC2)cc1 ZINC000649579561 566375123 /nfs/dbraw/zinc/37/51/23/566375123.db2.gz CQJLTFGJNPMEJB-GXTWGEPZSA-N 1 1 376.444 3.290 10 0 GGAEMO C[C@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccc(S(=O)(=O)NC2CC2)cc1 ZINC000649579561 566375129 /nfs/dbraw/zinc/37/51/29/566375129.db2.gz CQJLTFGJNPMEJB-GXTWGEPZSA-N 1 1 376.444 3.290 10 0 GGAEMO Cc1cc(Br)ccc1[C@@H]1CCC[N@H+]1C[C@@H](O)COC[C@H]1CCCO1 ZINC000626009181 566375182 /nfs/dbraw/zinc/37/51/82/566375182.db2.gz ANDLJYOCQYIGTQ-LMMKCTJWSA-N 1 1 398.341 3.451 10 0 GGAEMO Cc1cnc([C@@H]([NH2+]Cc2ccc(S(=O)(=O)NC3CC3)cc2)C2CC2)s1 ZINC000649583706 566375178 /nfs/dbraw/zinc/37/51/78/566375178.db2.gz WUCKQAICYQNZKZ-KRWDZBQOSA-N 1 1 377.535 3.133 10 0 GGAEMO O=C(C[N@H+]1C[C@@H]2CCC[C@]2(CO)C1)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000626013403 566375635 /nfs/dbraw/zinc/37/56/35/566375635.db2.gz IFTGMYLQRDDZDR-MEDUHNTESA-N 1 1 376.806 3.392 10 0 GGAEMO O=C(C[N@@H+]1C[C@@H]2CCC[C@]2(CO)C1)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000626013403 566375645 /nfs/dbraw/zinc/37/56/45/566375645.db2.gz IFTGMYLQRDDZDR-MEDUHNTESA-N 1 1 376.806 3.392 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2C)[C@@H](C)C1 ZINC000510338851 566376240 /nfs/dbraw/zinc/37/62/40/566376240.db2.gz GBHUXGWZILALPU-ZFWWWQNUSA-N 1 1 378.460 3.365 10 0 GGAEMO OC[C@]12CCC[C@H]1C[N@H+](Cc1nc(-c3cc(Br)cs3)no1)C2 ZINC000626013004 566376561 /nfs/dbraw/zinc/37/65/61/566376561.db2.gz PDXJZUXVLAUXPV-ZUZCIYMTSA-N 1 1 384.299 3.155 10 0 GGAEMO OC[C@]12CCC[C@H]1C[N@@H+](Cc1nc(-c3cc(Br)cs3)no1)C2 ZINC000626013004 566376570 /nfs/dbraw/zinc/37/65/70/566376570.db2.gz PDXJZUXVLAUXPV-ZUZCIYMTSA-N 1 1 384.299 3.155 10 0 GGAEMO C[C@@H](CNC(=O)c1nscc1Br)[N@H+]1CCc2ccccc2C1 ZINC000649598742 566376988 /nfs/dbraw/zinc/37/69/88/566376988.db2.gz VKPRKECDMJWODM-NSHDSACASA-N 1 1 380.311 3.082 10 0 GGAEMO COC[C@H](C)OC[C@H](O)C[N@H+]1CCC[C@@H]1c1ccc(Br)cc1C ZINC000626010040 566377145 /nfs/dbraw/zinc/37/71/45/566377145.db2.gz CLNQOVOETNTDED-YXJHDRRASA-N 1 1 386.330 3.307 10 0 GGAEMO O=S(=O)(NC1CC1)c1ccc(C[NH+]2CCC(CC(F)(F)F)CC2)cc1 ZINC000649604707 566377514 /nfs/dbraw/zinc/37/75/14/566377514.db2.gz SUJVURRRUDNGAW-UHFFFAOYSA-N 1 1 376.444 3.292 10 0 GGAEMO COCCc1noc(C[N@H+]2C[C@H](c3ccc(Br)cc3)C[C@@H]2C)n1 ZINC000626040938 566378273 /nfs/dbraw/zinc/37/82/73/566378273.db2.gz OHSFXMKTXXXSGM-GXTWGEPZSA-N 1 1 380.286 3.399 10 0 GGAEMO C[C@@H]1C[C@H](c2ccc(Br)cc2)C[N@H+]1CC[C@@H]1CCS(=O)(=O)C1 ZINC000626040999 566378379 /nfs/dbraw/zinc/37/83/79/566378379.db2.gz PHNFSOCKEDICML-FMKPAKJESA-N 1 1 386.355 3.452 10 0 GGAEMO CCOC(=O)COCC[N@@H+](C)[C@H]1CCSc2ccc(Br)cc21 ZINC000576791505 566378530 /nfs/dbraw/zinc/37/85/30/566378530.db2.gz CFVMVZXWCSKCPW-AWEZNQCLSA-N 1 1 388.327 3.498 10 0 GGAEMO C[C@H]1C[C@H](c2ccc(Br)cc2)C[N@H+]1Cc1cc(=O)n2nccc2[nH]1 ZINC000626040727 566378577 /nfs/dbraw/zinc/37/85/77/566378577.db2.gz KVLCFIYLSAWGGT-JSGCOSHPSA-N 1 1 387.281 3.163 10 0 GGAEMO C[N@H+](Cc1csc(-c2ccc(Br)cc2)n1)[C@H]1C[C@@H](C(N)=O)C1 ZINC000626038533 566378594 /nfs/dbraw/zinc/37/85/94/566378594.db2.gz PXVRXPOPBCXJHM-VDISTLRHSA-N 1 1 380.311 3.268 10 0 GGAEMO C[N@@H+](Cc1csc(-c2ccc(Br)cc2)n1)[C@H]1C[C@@H](C(N)=O)C1 ZINC000626038533 566378598 /nfs/dbraw/zinc/37/85/98/566378598.db2.gz PXVRXPOPBCXJHM-VDISTLRHSA-N 1 1 380.311 3.268 10 0 GGAEMO C[N@H+](Cc1cccc(OCC(F)(F)F)c1Br)[C@H]1C[C@@H](C(N)=O)C1 ZINC000626040022 566378703 /nfs/dbraw/zinc/37/87/03/566378703.db2.gz UXSDIZDHSOSAHO-PHIMTYICSA-N 1 1 395.219 3.086 10 0 GGAEMO C[N@@H+](Cc1cccc(OCC(F)(F)F)c1Br)[C@H]1C[C@@H](C(N)=O)C1 ZINC000626040022 566378704 /nfs/dbraw/zinc/37/87/04/566378704.db2.gz UXSDIZDHSOSAHO-PHIMTYICSA-N 1 1 395.219 3.086 10 0 GGAEMO C[C@H]1C[C@@H](c2ccc(Br)cc2)C[N@H+]1Cc1coc(S(N)(=O)=O)c1 ZINC000626040725 566378724 /nfs/dbraw/zinc/37/87/24/566378724.db2.gz KVBIABPSQQTYGG-SMDDNHRTSA-N 1 1 399.310 3.068 10 0 GGAEMO C[C@H]1C[C@H](c2ccc(Br)cc2)C[N@H+]1Cc1coc(S(N)(=O)=O)c1 ZINC000626040723 566378793 /nfs/dbraw/zinc/37/87/93/566378793.db2.gz KVBIABPSQQTYGG-FZMZJTMJSA-N 1 1 399.310 3.068 10 0 GGAEMO COCCc1nc(C[N@@H+]2C[C@@H](c3ccc(Br)cc3)C[C@@H]2C)no1 ZINC000626041283 566378882 /nfs/dbraw/zinc/37/88/82/566378882.db2.gz UFCXYLYRXIUJGC-JSGCOSHPSA-N 1 1 380.286 3.399 10 0 GGAEMO COCCc1nc(C[N@H+]2C[C@@H](c3ccc(Br)cc3)C[C@@H]2C)no1 ZINC000626041283 566378886 /nfs/dbraw/zinc/37/88/86/566378886.db2.gz UFCXYLYRXIUJGC-JSGCOSHPSA-N 1 1 380.286 3.399 10 0 GGAEMO COCCc1noc(C[N@H+]2C[C@H](c3ccc(Br)cc3)C[C@H]2C)n1 ZINC000626040941 566378935 /nfs/dbraw/zinc/37/89/35/566378935.db2.gz OHSFXMKTXXXSGM-TZMCWYRMSA-N 1 1 380.286 3.399 10 0 GGAEMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@@H]12)[C@H]1CCOc2ccc(Br)cc21 ZINC000649616499 566379208 /nfs/dbraw/zinc/37/92/08/566379208.db2.gz KGJHTJYDPYLWOK-IMJJTQAJSA-N 1 1 379.298 3.058 10 0 GGAEMO Cc1cc(C)c(C[S@@](=O)CC(=O)N2CCC[C@@H](C(F)(F)F)C2)c(C)[nH+]1 ZINC000600933424 566379589 /nfs/dbraw/zinc/37/95/89/566379589.db2.gz DJPVSJKOHNJNLF-DLUDVSRJSA-N 1 1 376.444 3.056 10 0 GGAEMO COc1ncc(Br)cc1Cc1noc(C[NH+]2CCC(C)CC2)n1 ZINC000576813927 566381531 /nfs/dbraw/zinc/38/15/31/566381531.db2.gz DEEPCHRJEDUUQK-UHFFFAOYSA-N 1 1 381.274 3.058 10 0 GGAEMO CNC(=O)C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1Cl)c1ccccc1 ZINC000483416518 566381977 /nfs/dbraw/zinc/38/19/77/566381977.db2.gz XNJXSVFEHHKFJQ-MRXNPFEDSA-N 1 1 380.275 3.399 10 0 GGAEMO C[C@@H](NC(=O)CN1CC[NH+](CCCF)CC1)c1ccc(Cl)c(Cl)c1 ZINC000626073324 566382519 /nfs/dbraw/zinc/38/25/19/566382519.db2.gz GRJSGPSNHWSHIX-CYBMUJFWSA-N 1 1 376.303 3.148 10 0 GGAEMO CNC(=O)C[C@H]([NH2+]Cc1nc2cc(Br)ccc2[nH]1)c1ccccc1 ZINC000483416263 566382558 /nfs/dbraw/zinc/38/25/58/566382558.db2.gz XGIYUQCBZGVERC-HNNXBMFYSA-N 1 1 387.281 3.292 10 0 GGAEMO [NH3+]CC(F)(F)CC(=O)N[C@@H](Cc1ccccn1)c1ccc(Br)cc1 ZINC000576833159 566382857 /nfs/dbraw/zinc/38/28/57/566382857.db2.gz GNRZLUIPXJXZQU-HNNXBMFYSA-N 1 1 398.251 3.228 10 0 GGAEMO CC(C)C[N@H+]1CC[C@H](CNC(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)C1 ZINC000626069396 566383027 /nfs/dbraw/zinc/38/30/27/566383027.db2.gz QTNYJWINWCQSRL-VLDUQVBPSA-N 1 1 391.353 3.429 10 0 GGAEMO C[C@@H](NC(=O)CC(C)(C)C)C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000510445172 566383515 /nfs/dbraw/zinc/38/35/15/566383515.db2.gz ZECAGSDXRZAODS-GFCCVEGCSA-N 1 1 398.345 3.390 10 0 GGAEMO C[C@H](NC(=O)C1CCCC1)C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000510442895 566383549 /nfs/dbraw/zinc/38/35/49/566383549.db2.gz MHOXPWIFASPFEO-LBPRGKRZSA-N 1 1 396.329 3.144 10 0 GGAEMO [NH3+]CC(F)(F)CC(=O)N[C@H](Cc1ccccn1)c1ccc(Br)cc1 ZINC000576833160 566383616 /nfs/dbraw/zinc/38/36/16/566383616.db2.gz GNRZLUIPXJXZQU-OAHLLOKOSA-N 1 1 398.251 3.228 10 0 GGAEMO C[C@@]1(Cc2cccc(Cl)c2)CCC[N@H+]1C[C@H]1CCCN(S(C)(=O)=O)C1 ZINC000649684191 566385963 /nfs/dbraw/zinc/38/59/63/566385963.db2.gz IKKAZYQGAAUEOJ-MJGOQNOKSA-N 1 1 384.973 3.409 10 0 GGAEMO [NH3+]CC(F)(F)CC(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000576883876 566386097 /nfs/dbraw/zinc/38/60/97/566386097.db2.gz ZDUGTJKDUZJTTF-UHFFFAOYSA-N 1 1 380.266 3.058 10 0 GGAEMO C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1 ZINC000510478191 566386220 /nfs/dbraw/zinc/38/62/20/566386220.db2.gz GCTHFUSRHHUGQM-KGLIPLIRSA-N 1 1 380.330 3.330 10 0 GGAEMO C[C@@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H](C)C1=CC[N@@H+](C)CC1 ZINC000510478190 566386616 /nfs/dbraw/zinc/38/66/16/566386616.db2.gz GCTHFUSRHHUGQM-KBPBESRZSA-N 1 1 380.330 3.330 10 0 GGAEMO CNS(=O)(=O)CCC[N@@H+](Cc1cccs1)Cc1ccc2[nH]ccc2c1 ZINC000626112616 566386745 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GGAEMO O=C1[C@@H]([NH2+]Cc2cccc(Br)c2F)CCCN1c1cccnc1 ZINC000449238364 566540877 /nfs/dbraw/zinc/54/08/77/566540877.db2.gz GBYYOLWEVXNYQW-HNNXBMFYSA-N 1 1 378.245 3.268 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(Cc3ccc(Br)c4cccnc34)[C@H]2C1 ZINC000559301547 566541387 /nfs/dbraw/zinc/54/13/87/566541387.db2.gz CQBYFJPNWSGHPV-ZWKOTPCHSA-N 1 1 390.325 3.292 10 0 GGAEMO COC(=O)[C@H]1CC[N@@H+]([C@H](C)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000603859210 566541760 /nfs/dbraw/zinc/54/17/60/566541760.db2.gz SVUFHEKCULSIFI-ZJUUUORDSA-N 1 1 378.778 3.181 10 0 GGAEMO COC(=O)[C@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000603859210 566541766 /nfs/dbraw/zinc/54/17/66/566541766.db2.gz SVUFHEKCULSIFI-ZJUUUORDSA-N 1 1 378.778 3.181 10 0 GGAEMO COC(=O)[C@@H]1CC[N@@H+]([C@@H](C)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000603859209 566541803 /nfs/dbraw/zinc/54/18/03/566541803.db2.gz SVUFHEKCULSIFI-VHSXEESVSA-N 1 1 378.778 3.181 10 0 GGAEMO COC(=O)[C@@H]1CC[N@H+]([C@@H](C)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000603859209 566541806 /nfs/dbraw/zinc/54/18/06/566541806.db2.gz SVUFHEKCULSIFI-VHSXEESVSA-N 1 1 378.778 3.181 10 0 GGAEMO COc1ncc(C(=O)NCCCC[N@H+]2CCC[C@H](C)C2)cc1Br ZINC000424584198 566541847 /nfs/dbraw/zinc/54/18/47/566541847.db2.gz AGLIQCQKZIHXJL-ZDUSSCGKSA-N 1 1 384.318 3.095 10 0 GGAEMO CCCOC[C@H](Cc1cccc(Br)c1)[NH2+]Cc1nccnc1OC ZINC000449252586 566542809 /nfs/dbraw/zinc/54/28/09/566542809.db2.gz VYTLAVMFQHSGSV-INIZCTEOSA-N 1 1 394.313 3.375 10 0 GGAEMO COc1c(Br)ccc(C)c1C(=O)NC[C@H](C)Cn1cc[nH+]c1C ZINC000424587677 566543522 /nfs/dbraw/zinc/54/35/22/566543522.db2.gz AOFJGXWONIINOJ-NSHDSACASA-N 1 1 380.286 3.337 10 0 GGAEMO COc1c(Br)ccc(C)c1C(=O)NC[C@@H](C)Cn1cc[nH+]c1C ZINC000424587674 566544009 /nfs/dbraw/zinc/54/40/09/566544009.db2.gz AOFJGXWONIINOJ-LLVKDONJSA-N 1 1 380.286 3.337 10 0 GGAEMO CNC(=O)[C@H](C)Oc1ccc(Br)cc1C[N@H+]1CC(C)=C[C@@H](C)C1 ZINC000449299693 566546375 /nfs/dbraw/zinc/54/63/75/566546375.db2.gz MLZKQMRGMHVTQV-OCCSQVGLSA-N 1 1 381.314 3.360 10 0 GGAEMO CNC(=O)[C@H](C)Oc1ccc(Br)cc1C[N@@H+]1CC(C)=C[C@@H](C)C1 ZINC000449299693 566546377 /nfs/dbraw/zinc/54/63/77/566546377.db2.gz MLZKQMRGMHVTQV-OCCSQVGLSA-N 1 1 381.314 3.360 10 0 GGAEMO C[N@H+]1CCCC12CCN(C(=O)[C@@H]1CCOc3ccc(Br)cc31)CC2 ZINC000651647854 566548621 /nfs/dbraw/zinc/54/86/21/566548621.db2.gz BVGXAFFAMQNMIT-OAHLLOKOSA-N 1 1 393.325 3.402 10 0 GGAEMO CN(C(=O)C1(c2cc(F)cc(Br)c2)CC1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000512676426 566548651 /nfs/dbraw/zinc/54/86/51/566548651.db2.gz BKGFCAGHZQMOGN-INIZCTEOSA-N 1 1 381.289 3.315 10 0 GGAEMO CC[C@H](Nc1cc[nH+]c(N2CCOCC2)n1)c1cc(F)cc(Br)c1 ZINC000486043745 566551234 /nfs/dbraw/zinc/55/12/34/566551234.db2.gz TXASDBXBAYRTOI-HNNXBMFYSA-N 1 1 395.276 3.200 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CN1CCN(Cc2c(F)cccc2Br)CC1 ZINC000538967712 566551521 /nfs/dbraw/zinc/55/15/21/566551521.db2.gz HDIZNADMBGLLMF-HNNXBMFYSA-N 1 1 384.337 3.190 10 0 GGAEMO C[C@@](CO)([NH2+]Cc1cc(Br)cc2c1OCC2)c1cccc(O)c1 ZINC000628374345 566552425 /nfs/dbraw/zinc/55/24/25/566552425.db2.gz FCCQBOBVLXACHA-SFHVURJKSA-N 1 1 378.266 3.087 10 0 GGAEMO C[N@@H+](Cc1cnc(-c2ccc(Br)cc2)s1)[C@]1(CO)CCOC1 ZINC000628367274 566552959 /nfs/dbraw/zinc/55/29/59/566552959.db2.gz RVALCVJOFGUBFB-INIZCTEOSA-N 1 1 383.311 3.156 10 0 GGAEMO C[C@H](NC(=O)[C@@H]1CCOc2ccc(Br)cc21)C1=CC[N@@H+](C)CC1 ZINC000651696288 566553349 /nfs/dbraw/zinc/55/33/49/566553349.db2.gz MJNWFPHZEVKNIX-SWLSCSKDSA-N 1 1 379.298 3.082 10 0 GGAEMO Cc1ccc(CNC(=O)c2nscc2Br)c(N2CCCC2)[nH+]1 ZINC000651696417 566553694 /nfs/dbraw/zinc/55/36/94/566553694.db2.gz QLSKFYSCRIYYHY-UHFFFAOYSA-N 1 1 381.299 3.139 10 0 GGAEMO CC[N@H+]1CCCC[C@@H]1CNC(=O)Cc1noc2ccc(Br)cc21 ZINC000424666716 566555485 /nfs/dbraw/zinc/55/54/85/566555485.db2.gz PQEXGJIPAMRJRM-CYBMUJFWSA-N 1 1 380.286 3.123 10 0 GGAEMO Cc1ncc(C[N@H+]2CC[C@H](Cc3cccc(I)c3)C2)cn1 ZINC000449388711 566556301 /nfs/dbraw/zinc/55/63/01/566556301.db2.gz AWNLOKXRTAQCIW-OAHLLOKOSA-N 1 1 393.272 3.454 10 0 GGAEMO Ic1cccc(C[C@@H]2CC[N@H+](Cc3csnn3)C2)c1 ZINC000449393906 566556531 /nfs/dbraw/zinc/55/65/31/566556531.db2.gz MXEFUGMKNDBKPN-LBPRGKRZSA-N 1 1 385.274 3.207 10 0 GGAEMO Ic1cccc(C[C@@H]2CC[N@@H+](Cc3csnn3)C2)c1 ZINC000449393906 566556534 /nfs/dbraw/zinc/55/65/34/566556534.db2.gz MXEFUGMKNDBKPN-LBPRGKRZSA-N 1 1 385.274 3.207 10 0 GGAEMO COc1cc(OC)c(C[NH2+][C@@H](CO)c2cccc(Br)c2)cc1F ZINC000651732466 566556543 /nfs/dbraw/zinc/55/65/43/566556543.db2.gz WBDWPASBTADTIG-HNNXBMFYSA-N 1 1 384.245 3.429 10 0 GGAEMO Ic1cccc(C[C@H]2CC[N@@H+](Cc3cncnc3)C2)c1 ZINC000449394334 566556652 /nfs/dbraw/zinc/55/66/52/566556652.db2.gz NRQLWLISNUQZNH-CQSZACIVSA-N 1 1 379.245 3.146 10 0 GGAEMO OC[C@]12CCC[C@H]1C[N@@H+](Cc1nc(-c3ccc(Br)cc3)c[nH]1)C2 ZINC000628460953 566557030 /nfs/dbraw/zinc/55/70/30/566557030.db2.gz BZXFCYXRRAGYMD-KBXCAEBGSA-N 1 1 376.298 3.434 10 0 GGAEMO OC[C@]12CCC[C@H]1C[N@@H+](Cc1nc(-c3cccc(Br)c3)c[nH]1)C2 ZINC000628461071 566557398 /nfs/dbraw/zinc/55/73/98/566557398.db2.gz HSHYNKKWUJGQAZ-KBXCAEBGSA-N 1 1 376.298 3.434 10 0 GGAEMO NC(=O)C[C@H]1C[N@H+](Cc2ccc(-c3cccc(Br)c3)s2)CCO1 ZINC000628474270 566557474 /nfs/dbraw/zinc/55/74/74/566557474.db2.gz RBFCVEQCDHHABV-AWEZNQCLSA-N 1 1 395.322 3.254 10 0 GGAEMO NC(=O)C[C@H]1C[N@@H+](Cc2ccc(-c3cccc(Br)c3)s2)CCO1 ZINC000628474270 566557477 /nfs/dbraw/zinc/55/74/77/566557477.db2.gz RBFCVEQCDHHABV-AWEZNQCLSA-N 1 1 395.322 3.254 10 0 GGAEMO CC1=CC[N@@H+](CCNC(=O)[C@H]2CCOc3ccc(Br)cc32)CC1 ZINC000651736025 566557671 /nfs/dbraw/zinc/55/76/71/566557671.db2.gz LBWYBTGGHHFSCC-HNNXBMFYSA-N 1 1 379.298 3.083 10 0 GGAEMO NC(=O)C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3Br)cc2)CCO1 ZINC000628475403 566558025 /nfs/dbraw/zinc/55/80/25/566558025.db2.gz QZCQNFKYRNFSTH-MRXNPFEDSA-N 1 1 389.293 3.192 10 0 GGAEMO NC(=O)C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3Br)cc2)CCO1 ZINC000628475403 566558032 /nfs/dbraw/zinc/55/80/32/566558032.db2.gz QZCQNFKYRNFSTH-MRXNPFEDSA-N 1 1 389.293 3.192 10 0 GGAEMO Cc1[nH+]ccn1CCCCNC(=O)Cc1noc2ccc(Br)cc12 ZINC000424694784 566558385 /nfs/dbraw/zinc/55/83/85/566558385.db2.gz WQQRGOIDWYZFFF-UHFFFAOYSA-N 1 1 391.269 3.234 10 0 GGAEMO Cc1n[nH]cc1C[N@H+]1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000449397216 566558441 /nfs/dbraw/zinc/55/84/41/566558441.db2.gz UPSQCFNQNSMUFT-AWEZNQCLSA-N 1 1 381.261 3.387 10 0 GGAEMO Cc1[nH]ncc1C[N@@H+]1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000449397216 566558446 /nfs/dbraw/zinc/55/84/46/566558446.db2.gz UPSQCFNQNSMUFT-AWEZNQCLSA-N 1 1 381.261 3.387 10 0 GGAEMO Cc1[nH]ncc1C[N@H+]1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000449397216 566558449 /nfs/dbraw/zinc/55/84/49/566558449.db2.gz UPSQCFNQNSMUFT-AWEZNQCLSA-N 1 1 381.261 3.387 10 0 GGAEMO CC[C@H]1[C@@H](CO)CC[N@@H+]1Cc1cc(Br)cc(Br)c1N ZINC000449423551 566560648 /nfs/dbraw/zinc/56/06/48/566560648.db2.gz OCUKAFQDFAZCRN-RNCFNFMXSA-N 1 1 392.135 3.387 10 0 GGAEMO CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1cc(Br)cc(Br)c1N ZINC000449423551 566560653 /nfs/dbraw/zinc/56/06/53/566560653.db2.gz OCUKAFQDFAZCRN-RNCFNFMXSA-N 1 1 392.135 3.387 10 0 GGAEMO 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C[NH+](C)[C@@H](CNC(=O)[C@H]1CCc2cc(Br)ccc21)c1ccco1 ZINC000581430764 566776869 /nfs/dbraw/zinc/77/68/69/566776869.db2.gz NGMJNDUWBKAWLM-HOTGVXAUSA-N 1 1 377.282 3.491 10 0 GGAEMO CN(Cc1ccc(Br)c(F)c1)C(=O)Cn1c[nH+]c2c1CCCC2 ZINC000516701242 566778796 /nfs/dbraw/zinc/77/87/96/566778796.db2.gz KKNUTJYQMGWQQO-UHFFFAOYSA-N 1 1 380.261 3.322 10 0 GGAEMO C[NH+](C)[C@@H](C(=O)N(CCO)Cc1cc(Br)cs1)c1ccccc1 ZINC000427546113 566779006 /nfs/dbraw/zinc/77/90/06/566779006.db2.gz ZMHLUSKNMDWMCZ-MRXNPFEDSA-N 1 1 397.338 3.134 10 0 GGAEMO CC[C@@H]([NH2+]Cc1cn(C[C@@H]2CCOC2)nn1)c1cc(F)cc(Br)c1 ZINC000631114645 566779645 /nfs/dbraw/zinc/77/96/45/566779645.db2.gz GTHSJZYYCAAMAB-YVEFUNNKSA-N 1 1 397.292 3.457 10 0 GGAEMO CCO[C@@H]1C[C@@H]([NH2+]Cc2ncc(Br)cc2Cl)[C@]12CCCO2 ZINC000631113213 566779980 /nfs/dbraw/zinc/77/99/80/566779980.db2.gz ULHUYKGRQRWCDS-RBSFLKMASA-N 1 1 375.694 3.314 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)Nc1cccc(Br)c1Cl ZINC000516744983 566780592 /nfs/dbraw/zinc/78/05/92/566780592.db2.gz 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ZINC000631141715 566784787 /nfs/dbraw/zinc/78/47/87/566784787.db2.gz HOKZGSDTKQQWBE-INIZCTEOSA-N 1 1 382.277 3.024 10 0 GGAEMO CCO[C@@H]1C[C@H]([NH2+]Cc2ncc(Br)cc2Cl)[C@H]1n1cccn1 ZINC000631145610 566785211 /nfs/dbraw/zinc/78/52/11/566785211.db2.gz NNYVCUQLWDUNQK-NWANDNLSSA-N 1 1 385.693 3.202 10 0 GGAEMO Cn1nc2c(c1C[NH2+][C@H](CO)c1ccc(Br)c(F)c1)CCCC2 ZINC000631141719 566785885 /nfs/dbraw/zinc/78/58/85/566785885.db2.gz HOKZGSDTKQQWBE-MRXNPFEDSA-N 1 1 382.277 3.024 10 0 GGAEMO CCS(=O)(=O)c1cc(Cl)cc(C[NH2+]Cc2ccnn2CC2CCC2)c1 ZINC000631161608 566786807 /nfs/dbraw/zinc/78/68/07/566786807.db2.gz PBBWBLISNMURFV-UHFFFAOYSA-N 1 1 381.929 3.420 10 0 GGAEMO C[C@@H](C(=O)Nc1cc(Br)cc(C(C)(C)C)c1O)N1CC[NH+](C)CC1 ZINC000655204558 566786819 /nfs/dbraw/zinc/78/68/19/566786819.db2.gz MGCOBPAGTUCQSS-LBPRGKRZSA-N 1 1 398.345 3.027 10 0 GGAEMO C[C@H](C(=O)Nc1cc(Br)cc(C(C)(C)C)c1O)N1CC[NH+](C)CC1 ZINC000655204556 566787742 /nfs/dbraw/zinc/78/77/42/566787742.db2.gz MGCOBPAGTUCQSS-GFCCVEGCSA-N 1 1 398.345 3.027 10 0 GGAEMO C[N@H+](CCc1cccc(F)c1F)[C@H](C(N)=O)c1cccc(Br)c1 ZINC000542265468 566788823 /nfs/dbraw/zinc/78/88/23/566788823.db2.gz IFCQREJORSPAFD-INIZCTEOSA-N 1 1 383.236 3.428 10 0 GGAEMO C[N@@H+](CCc1cccc(F)c1F)[C@H](C(N)=O)c1cccc(Br)c1 ZINC000542265468 566788826 /nfs/dbraw/zinc/78/88/26/566788826.db2.gz IFCQREJORSPAFD-INIZCTEOSA-N 1 1 383.236 3.428 10 0 GGAEMO CC[C@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc[nH]c(=O)c2Br)C1 ZINC000469410316 566789067 /nfs/dbraw/zinc/78/90/67/566789067.db2.gz PTWFRJXKFOFZAQ-LBPRGKRZSA-N 1 1 384.318 3.180 10 0 GGAEMO CC[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2cc[nH]c(=O)c2Br)C1 ZINC000469410315 566789133 /nfs/dbraw/zinc/78/91/33/566789133.db2.gz PTWFRJXKFOFZAQ-GFCCVEGCSA-N 1 1 384.318 3.180 10 0 GGAEMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(Br)c2c1OCCC2 ZINC000469437812 566790716 /nfs/dbraw/zinc/79/07/16/566790716.db2.gz CQUVLUVRIRUTIZ-OLZOCXBDSA-N 1 1 379.298 3.083 10 0 GGAEMO O[C@@H]1C[C@H]([C@@H]2CCCOC2)[N@@H+](Cc2cc(Br)cc3cccnc32)C1 ZINC000451295091 566790902 /nfs/dbraw/zinc/79/09/02/566790902.db2.gz CWBURJFIOGMQKN-ZTFGCOKTSA-N 1 1 391.309 3.359 10 0 GGAEMO O=C(c1cc(Cl)ccc1SC1CCCC1)N1CC[N@H+]2C[C@H](O)C[C@H]2C1 ZINC000655295199 566791992 /nfs/dbraw/zinc/79/19/92/566791992.db2.gz AWEBJJSJLIFPLZ-LSDHHAIUSA-N 1 1 380.941 3.266 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)[C@@H](O)CCc2ccccc2)cc1Br ZINC000469483545 566792740 /nfs/dbraw/zinc/79/27/40/566792740.db2.gz HVYUWHIVVHBYNH-SFHVURJKSA-N 1 1 391.309 3.443 10 0 GGAEMO O[C@@H]1C[C@@H]([C@@H]2CCCOC2)[N@H+](Cc2c(F)ccc(Br)c2F)C1 ZINC000451306152 566792893 /nfs/dbraw/zinc/79/28/93/566792893.db2.gz RLWHQYOPLAPUSZ-HFAKWTLXSA-N 1 1 376.241 3.089 10 0 GGAEMO O[C@@H]1C[C@@H]([C@@H]2CCCOC2)[N@@H+](Cc2c(F)ccc(Br)c2F)C1 ZINC000451306152 566792900 /nfs/dbraw/zinc/79/29/00/566792900.db2.gz RLWHQYOPLAPUSZ-HFAKWTLXSA-N 1 1 376.241 3.089 10 0 GGAEMO O[C@@H]1C[C@H](O)C[N@H+](Cc2ccc(OCc3ccc(Cl)c(Cl)c3)cc2)C1 ZINC000678297932 566793061 /nfs/dbraw/zinc/79/30/61/566793061.db2.gz LIXFWLCJHKNBBL-IYBDPMFKSA-N 1 1 382.287 3.500 10 0 GGAEMO C[N@H+](CCN1CCCS1(=O)=O)Cc1ccc(Sc2ccccc2)cc1 ZINC000678298906 566793113 /nfs/dbraw/zinc/79/31/13/566793113.db2.gz WFWULCYKTMHRNB-UHFFFAOYSA-N 1 1 376.547 3.305 10 0 GGAEMO C[N@@H+](CCN1CCCS1(=O)=O)Cc1ccc(Sc2ccccc2)cc1 ZINC000678298906 566793121 /nfs/dbraw/zinc/79/31/21/566793121.db2.gz WFWULCYKTMHRNB-UHFFFAOYSA-N 1 1 376.547 3.305 10 0 GGAEMO Cc1n[nH]c(C)c1CCC(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000469488292 566794406 /nfs/dbraw/zinc/79/44/06/566794406.db2.gz QRUTZDAZPVCLSA-UHFFFAOYSA-N 1 1 379.302 3.422 10 0 GGAEMO CCn1nc2c(cc1=O)C[N@H+]([C@@H]1CCCc3ccc(Br)cc31)CC2 ZINC000678313202 566795335 /nfs/dbraw/zinc/79/53/35/566795335.db2.gz RNIZIXDHZFADIK-GOSISDBHSA-N 1 1 388.309 3.461 10 0 GGAEMO CCn1nc2c(cc1=O)C[N@@H+]([C@@H]1CCCc3ccc(Br)cc31)CC2 ZINC000678313202 566795339 /nfs/dbraw/zinc/79/53/39/566795339.db2.gz RNIZIXDHZFADIK-GOSISDBHSA-N 1 1 388.309 3.461 10 0 GGAEMO OC1([C@@H]2CCCC[N@@H+]2Cc2nc(Cc3cccc(Br)c3)no2)CC1 ZINC000517015865 566799957 /nfs/dbraw/zinc/79/99/57/566799957.db2.gz IMTCZRBFVLXXRR-HNNXBMFYSA-N 1 1 392.297 3.302 10 0 GGAEMO OC1([C@@H]2CCCC[N@H+]2Cc2nc(Cc3cccc(Br)c3)no2)CC1 ZINC000517015865 566799964 /nfs/dbraw/zinc/79/99/64/566799964.db2.gz IMTCZRBFVLXXRR-HNNXBMFYSA-N 1 1 392.297 3.302 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)[C@H]1CCc2cc(Br)ccc21 ZINC000517032230 566800990 /nfs/dbraw/zinc/80/09/90/566800990.db2.gz QQEFGBMWIOIKNL-SJCJKPOMSA-N 1 1 376.298 3.436 10 0 GGAEMO C[C@@H](CCNC(=O)c1n[nH]c2ccc(Br)cc21)[NH+]1CCCCC1 ZINC000542451595 566801962 /nfs/dbraw/zinc/80/19/62/566801962.db2.gz LLBYWABFNGYYJQ-LBPRGKRZSA-N 1 1 379.302 3.320 10 0 GGAEMO C[N@H+]1CC[C@@H](NS(=O)(=O)Cc2c(F)cccc2Cl)[C@@H]1c1ccccc1 ZINC000451351230 566802310 /nfs/dbraw/zinc/80/23/10/566802310.db2.gz INDATWUIHHEXOA-MSOLQXFVSA-N 1 1 382.888 3.344 10 0 GGAEMO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)c2ccc(Br)c3c2OCCC3)C1 ZINC000469599944 566802377 /nfs/dbraw/zinc/80/23/77/566802377.db2.gz BPNSDEFMYLNMPF-BLLLJJGKSA-N 1 1 381.314 3.233 10 0 GGAEMO Cc1nc(-c2cc3c(s2)CCN(C(=O)N[C@H]2CCC[N@H+](C)C2)C3)cs1 ZINC000678508000 566804405 /nfs/dbraw/zinc/80/44/05/566804405.db2.gz WLQSHECSMJUEMM-AWEZNQCLSA-N 1 1 376.551 3.342 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2csc(CCC(F)(F)F)n2)[C@H](C)C1 ZINC000631463993 566804499 /nfs/dbraw/zinc/80/44/99/566804499.db2.gz CPOMOJYUDQQUDW-OCCSQVGLSA-N 1 1 377.476 3.369 10 0 GGAEMO O=C(c1nc2cc(Cl)ccc2s1)N1CCC([N@H+]2CCCOCC2)CC1 ZINC000631491866 566806091 /nfs/dbraw/zinc/80/60/91/566806091.db2.gz GOGTWYFYBCBFBJ-UHFFFAOYSA-N 1 1 379.913 3.277 10 0 GGAEMO O=C(Nc1ccc(Br)cc1)N1CCC([N@H+]2CCCOCC2)CC1 ZINC000631494558 566806297 /nfs/dbraw/zinc/80/62/97/566806297.db2.gz PJJIFCUKDUEDFX-UHFFFAOYSA-N 1 1 382.302 3.168 10 0 GGAEMO COCCN1CCC[N@@H+](CC/C=C/c2ccc(Br)cc2)CC1=O ZINC000469689066 566807624 /nfs/dbraw/zinc/80/76/24/566807624.db2.gz DSCUNCLMZLOBSB-GORDUTHDSA-N 1 1 381.314 3.033 10 0 GGAEMO Cc1csc(-c2ccc(S(=O)(=O)N(C)[C@@H]3CC[N@@H+](C)[C@@H](C)C3)cc2)n1 ZINC000655523363 566808368 /nfs/dbraw/zinc/80/83/68/566808368.db2.gz HMQPAWFQOXSWCJ-GOEBONIOSA-N 1 1 379.551 3.222 10 0 GGAEMO COC(=O)c1nc(NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)sc1C ZINC000427981329 566808354 /nfs/dbraw/zinc/80/83/54/566808354.db2.gz CGFVQQBALFVZPS-UHFFFAOYSA-N 1 1 379.913 3.390 10 0 GGAEMO Cc1csc(-c2ccc(S(=O)(=O)N(C)[C@H]3CC[N@@H+](C)[C@H](C)C3)cc2)n1 ZINC000655523365 566808749 /nfs/dbraw/zinc/80/87/49/566808749.db2.gz HMQPAWFQOXSWCJ-ZBFHGGJFSA-N 1 1 379.551 3.222 10 0 GGAEMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@@H]2[C@@H]3Cc4cc(Br)ccc4[C@@H]32)C1 ZINC000631555377 566809625 /nfs/dbraw/zinc/80/96/25/566809625.db2.gz AQRBRFZZORYPFI-PSMGESJCSA-N 1 1 377.326 3.135 10 0 GGAEMO CC[N@H+](CCNS(=O)(=O)c1ccc2nc(C)sc2c1)CCC(F)(F)F ZINC000489794415 566810185 /nfs/dbraw/zinc/81/01/85/566810185.db2.gz FYETTXFJEOSYMD-UHFFFAOYSA-N 1 1 395.472 3.157 10 0 GGAEMO CC[N@@H+](CCNS(=O)(=O)c1ccc2nc(C)sc2c1)CCC(F)(F)F ZINC000489794415 566810192 /nfs/dbraw/zinc/81/01/92/566810192.db2.gz FYETTXFJEOSYMD-UHFFFAOYSA-N 1 1 395.472 3.157 10 0 GGAEMO CC[C@@H](C[N@@H+](C)CCCS(=O)(=O)NC)Oc1ccc(Cl)c(Cl)c1 ZINC000469748152 566810643 /nfs/dbraw/zinc/81/06/43/566810643.db2.gz HXPZPAUULIJOCD-LBPRGKRZSA-N 1 1 383.341 3.022 10 0 GGAEMO CCCNS(=O)(=O)N[C@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000489864444 566814493 /nfs/dbraw/zinc/81/44/93/566814493.db2.gz VLSFGMMPKPIKOT-NXCDMZCRSA-N 1 1 385.961 3.088 10 0 GGAEMO COCC[N@H+](Cc1ccnn1C)Cc1ccc(Br)c2cccnc12 ZINC000489865116 566814795 /nfs/dbraw/zinc/81/47/95/566814795.db2.gz MONPMTOIPIEGRA-UHFFFAOYSA-N 1 1 389.297 3.379 10 0 GGAEMO COCC[N@@H+](Cc1ccnn1C)Cc1ccc(Br)c2cccnc12 ZINC000489865116 566814799 /nfs/dbraw/zinc/81/47/99/566814799.db2.gz MONPMTOIPIEGRA-UHFFFAOYSA-N 1 1 389.297 3.379 10 0 GGAEMO CC[C@H]([NH2+]Cc1ccc(Br)cc1N1CCOCC1)c1ccn(C)n1 ZINC000542667226 566816674 /nfs/dbraw/zinc/81/66/74/566816674.db2.gz GKFSTOBALBUCGE-INIZCTEOSA-N 1 1 393.329 3.260 10 0 GGAEMO O[C@@]1(C(F)F)CC[N@@H+](Cc2ccnc(-c3ccc(Br)cc3)n2)C1 ZINC000451434871 566816876 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Cc1ccc(NC(=O)C[NH2+][C@H](CO)c2cccc(Br)c2)c(F)c1 ZINC000542910968 566837824 /nfs/dbraw/zinc/83/78/24/566837824.db2.gz QRCHZKBVIMTCQM-MRXNPFEDSA-N 1 1 381.245 3.158 10 0 GGAEMO Brc1ccc(-c2nc(CN[C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)n[nH]2)cc1 ZINC000562959581 566838790 /nfs/dbraw/zinc/83/87/90/566838790.db2.gz YSAPPUSWYMYGKX-ARFHVFGLSA-N 1 1 390.329 3.245 10 0 GGAEMO Brc1ccc(-c2n[nH]c(CN[C@@H]3CCC[C@H]3[C@H]3CCC[NH2+]3)n2)cc1 ZINC000562959581 566838797 /nfs/dbraw/zinc/83/87/97/566838797.db2.gz YSAPPUSWYMYGKX-ARFHVFGLSA-N 1 1 390.329 3.245 10 0 GGAEMO O=C(c1c(F)cncc1Br)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000632012227 566839735 /nfs/dbraw/zinc/83/97/35/566839735.db2.gz NIINPTVHIXSYRX-IAQYHMDHSA-N 1 1 382.277 3.072 10 0 GGAEMO O=C(c1c(F)cncc1Br)N1CC[C@@H]2[C@@H](CCC[N@H+]2C2CC2)C1 ZINC000632012229 566839762 /nfs/dbraw/zinc/83/97/62/566839762.db2.gz NIINPTVHIXSYRX-XHDPSFHLSA-N 1 1 382.277 3.072 10 0 GGAEMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000610538599 566840087 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C[C@H]1CN(Cc2cnc(-c3ccc(Br)cc3)s2)CC[N@H+]1CCO ZINC000428460157 566844843 /nfs/dbraw/zinc/84/48/43/566844843.db2.gz FYMXSKPCITUBMA-ZDUSSCGKSA-N 1 1 396.354 3.071 10 0 GGAEMO C[C@H]1C[N@H+](Cc2cnc(-c3ccc(Br)cc3)s2)CCN1CCO ZINC000428460157 566844849 /nfs/dbraw/zinc/84/48/49/566844849.db2.gz FYMXSKPCITUBMA-ZDUSSCGKSA-N 1 1 396.354 3.071 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2cnc(-c3ccc(Br)cc3)s2)CCN1CCO ZINC000428460157 566844855 /nfs/dbraw/zinc/84/48/55/566844855.db2.gz FYMXSKPCITUBMA-ZDUSSCGKSA-N 1 1 396.354 3.071 10 0 GGAEMO Brc1cccc2c1OCC[C@@H]2NC1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000655763542 566846059 /nfs/dbraw/zinc/84/60/59/566846059.db2.gz PRSILKIXACWSJJ-PBHICJAKSA-N 1 1 381.314 3.116 10 0 GGAEMO CSc1ccc([C@H](CNS(=O)(=O)C[C@@H]2CCCC2(F)F)[NH+](C)C)cc1 ZINC000451592979 566847154 /nfs/dbraw/zinc/84/71/54/566847154.db2.gz PXJRSFJBKSRWFG-HOCLYGCPSA-N 1 1 392.537 3.366 10 0 GGAEMO O=C(NCCc1ccsc1)NC[C@H]1CSCC[N@@H+]1Cc1ccccc1 ZINC000428470415 566847415 /nfs/dbraw/zinc/84/74/15/566847415.db2.gz OUBMLYFXOZFGGU-SFHVURJKSA-N 1 1 375.563 3.207 10 0 GGAEMO O=C(NCCc1ccsc1)NC[C@H]1CSCC[N@H+]1Cc1ccccc1 ZINC000428470415 566847422 /nfs/dbraw/zinc/84/74/22/566847422.db2.gz OUBMLYFXOZFGGU-SFHVURJKSA-N 1 1 375.563 3.207 10 0 GGAEMO COc1ccc(Br)cc1C1(NC2CC[NH+]([C@H]3CCOC3)CC2)CC1 ZINC000655779676 566849384 /nfs/dbraw/zinc/84/93/84/566849384.db2.gz QIEONGDETIFFAI-INIZCTEOSA-N 1 1 395.341 3.290 10 0 GGAEMO COc1ccc(Br)cc1C1(NC2CC[NH+]([C@@H]3CCOC3)CC2)CC1 ZINC000655779677 566849871 /nfs/dbraw/zinc/84/98/71/566849871.db2.gz QIEONGDETIFFAI-MRXNPFEDSA-N 1 1 395.341 3.290 10 0 GGAEMO CC[C@H]1C[N@@H+](C)CCN1C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000563064776 566850307 /nfs/dbraw/zinc/85/03/07/566850307.db2.gz WFXQVCGPIKVQDH-SWLSCSKDSA-N 1 1 382.302 3.008 10 0 GGAEMO CC[C@H]1C[N@@H+](C)CCN1C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000563064778 566851369 /nfs/dbraw/zinc/85/13/69/566851369.db2.gz WFXQVCGPIKVQDH-WFASDCNBSA-N 1 1 382.302 3.008 10 0 GGAEMO Cc1nc(-c2cccc(NC(=O)CSC[C@@H]3C[N@H+](C)CCO3)c2)cs1 ZINC000563118624 566856631 /nfs/dbraw/zinc/85/66/31/566856631.db2.gz FESYHHSFEKSDSR-INIZCTEOSA-N 1 1 377.535 3.121 10 0 GGAEMO Cc1nc(-c2cccc(NC(=O)CSC[C@@H]3C[N@@H+](C)CCO3)c2)cs1 ZINC000563118624 566856637 /nfs/dbraw/zinc/85/66/37/566856637.db2.gz FESYHHSFEKSDSR-INIZCTEOSA-N 1 1 377.535 3.121 10 0 GGAEMO O[C@H](COC[C@@H]1CCCO1)C[N@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000543176822 566859655 /nfs/dbraw/zinc/85/96/55/566859655.db2.gz MIXSCPBMMBXNPN-IHRRRGAJSA-N 1 1 390.343 3.204 10 0 GGAEMO O=C(CN1CC[C@H]2C[NH2+]C[C@H]2CC1)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000563149871 566859591 /nfs/dbraw/zinc/85/95/91/566859591.db2.gz LYSFNEGIIFCDBX-TXEJJXNPSA-N 1 1 375.822 3.229 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)N1CC[C@@H](C[N@@H+](C)CC2CC2)C1 ZINC000470239474 566860364 /nfs/dbraw/zinc/86/03/64/566860364.db2.gz ZIFHNBOUGPRRST-HNNXBMFYSA-N 1 1 395.341 3.191 10 0 GGAEMO Cc1c(Br)cccc1CS(=O)(=O)N1CC[NH2+]Cc2ccccc21 ZINC000655950004 566860834 /nfs/dbraw/zinc/86/08/34/566860834.db2.gz HMMBOIXJFSHWEA-UHFFFAOYSA-N 1 1 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CCCWMFQNKUEFRO-ZDUSSCGKSA-N 1 1 383.261 3.130 10 0 GGAEMO CCC[C@@H]1CN(C(=O)Cc2cscc2Br)CC[N@H+]1CCOC ZINC000495132387 567048173 /nfs/dbraw/zinc/04/81/73/567048173.db2.gz WDHYEJBCIUYNKX-CQSZACIVSA-N 1 1 389.359 3.012 10 0 GGAEMO O=C(Nc1nnc(-c2c(F)cccc2Cl)s1)[C@@H]1CCc2[nH]cnc2C1 ZINC000613616339 567049875 /nfs/dbraw/zinc/04/98/75/567049875.db2.gz RMGNWEMWUFNXIP-MRVPVSSYSA-N 1 1 377.832 3.464 10 0 GGAEMO c1csc(-c2noc(CCC[N@H+]3CCCN(c4nccs4)CC3)n2)c1 ZINC000521226647 567050366 /nfs/dbraw/zinc/05/03/66/567050366.db2.gz DIXCSDHUPGBLKM-UHFFFAOYSA-N 1 1 375.523 3.400 10 0 GGAEMO Fc1cncc(Br)c1CNc1ccc(C[NH+]2CCOCC2)cc1 ZINC000657404692 567054226 /nfs/dbraw/zinc/05/42/26/567054226.db2.gz LYHASJHONHYDNQ-UHFFFAOYSA-N 1 1 380.261 3.428 10 0 GGAEMO Fc1cncc(Br)c1C[NH2+][C@@H]1CCN(c2ncccc2Cl)C1 ZINC000657395860 567054690 /nfs/dbraw/zinc/05/46/90/567054690.db2.gz YULGSICVCDJUSI-SNVBAGLBSA-N 1 1 385.668 3.400 10 0 GGAEMO Cc1nc(-c2ccc(Cl)s2)sc1C(=O)NC[C@@H]1CCCC[N@H+]1CCO ZINC000584571793 567056476 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Cc1cc(Br)ccc1NC(=O)C[N@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000495445192 567060563 /nfs/dbraw/zinc/06/05/63/567060563.db2.gz ROFRZBBHVIJILA-HOCLYGCPSA-N 1 1 383.330 3.425 10 0 GGAEMO COc1ccc([C@H](CNc2ncncc2Br)[NH+]2CCCCC2)cc1 ZINC000473091645 567064247 /nfs/dbraw/zinc/06/42/47/567064247.db2.gz AHJLPWNELZDTCA-KRWDZBQOSA-N 1 1 391.313 3.309 10 0 GGAEMO C[C@H]([NH2+][C@H](CO)c1ccsc1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000473159718 567064924 /nfs/dbraw/zinc/06/49/24/567064924.db2.gz DBZORNIBJDPLKN-SWLSCSKDSA-N 1 1 375.519 3.028 10 0 GGAEMO C[C@H]([NH2+][C@@H](CO)c1ccsc1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000473159719 567065764 /nfs/dbraw/zinc/06/57/64/567065764.db2.gz DBZORNIBJDPLKN-WFASDCNBSA-N 1 1 375.519 3.028 10 0 GGAEMO C[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(CCn3cc(Br)cn3)cc2)C1 ZINC000584731006 567065788 /nfs/dbraw/zinc/06/57/88/567065788.db2.gz VUTZXSJFKGFEON-CQSZACIVSA-N 1 1 391.313 3.169 10 0 GGAEMO Cc1cc(NC(=O)[C@@H](C)[NH2+][C@H](CO)c2ccsc2)ccc1Br ZINC000473165868 567065959 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[O-]c1cccc(C[NH2+]CC2CC[NH+](C3CCOCC3)CC2)c1Br ZINC000657537279 567067763 /nfs/dbraw/zinc/06/77/63/567067763.db2.gz GMPOENXBXHZDHT-UHFFFAOYSA-N 1 1 383.330 3.135 10 0 GGAEMO COc1ccc(C[NH2+]Cc2ccc(CNC(C)=O)cc2)c(Br)c1O ZINC000657544069 567068004 /nfs/dbraw/zinc/06/80/04/567068004.db2.gz LXYNCQOYUVDWSM-UHFFFAOYSA-N 1 1 393.281 3.089 10 0 GGAEMO O=C(C[NH2+][C@H](CO)c1ccsc1)Nc1ccc(OC(F)F)c(Cl)c1 ZINC000473175798 567067938 /nfs/dbraw/zinc/06/79/38/567067938.db2.gz PPMDROYPDUOBMY-GFCCVEGCSA-N 1 1 376.812 3.265 10 0 GGAEMO OCCC[N@@H+]1CCC[C@@H]1CN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000453266980 567068788 /nfs/dbraw/zinc/06/87/88/567068788.db2.gz OVHCDUNOUIZAEM-NVXWUHKLSA-N 1 1 383.330 3.099 10 0 GGAEMO OCCC[N@H+]1CCC[C@@H]1CN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000453266980 567068793 /nfs/dbraw/zinc/06/87/93/567068793.db2.gz OVHCDUNOUIZAEM-NVXWUHKLSA-N 1 1 383.330 3.099 10 0 GGAEMO C[C@@H](C(=O)Nc1ccc(Br)cc1)[N@@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000613887068 567069324 /nfs/dbraw/zinc/06/93/24/567069324.db2.gz HNRHVZIPFPYXPV-UONOGXRCSA-N 1 1 389.297 3.446 10 0 GGAEMO C[C@@H](C(=O)Nc1ccc(Br)cc1)[N@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000613887068 567069328 /nfs/dbraw/zinc/06/93/28/567069328.db2.gz HNRHVZIPFPYXPV-UONOGXRCSA-N 1 1 389.297 3.446 10 0 GGAEMO COc1ccc(Br)cc1C[NH2+][C@H]1Cc2ccccc2N(C)C1=O ZINC000657572539 567071312 /nfs/dbraw/zinc/07/13/12/567071312.db2.gz ZWSUREZVOFCTRA-HNNXBMFYSA-N 1 1 375.266 3.135 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(Br)cc2ccccc21 ZINC000521646895 567072793 /nfs/dbraw/zinc/07/27/93/567072793.db2.gz BUJAYOLVGQKINS-MRXNPFEDSA-N 1 1 391.309 3.443 10 0 GGAEMO O[C@@H]1CC[N@@H+](Cc2ccc(CNCc3cccc(F)c3Br)cc2)C1 ZINC000657595726 567074508 /nfs/dbraw/zinc/07/45/08/567074508.db2.gz JOBWLMCOELPYAQ-QGZVFWFLSA-N 1 1 393.300 3.445 10 0 GGAEMO O[C@H]1CC[N@H+](Cc2ccc(CNCc3cccc(Br)c3F)cc2)C1 ZINC000657596455 567074901 /nfs/dbraw/zinc/07/49/01/567074901.db2.gz NHQURHJYFDLQAD-KRWDZBQOSA-N 1 1 393.300 3.445 10 0 GGAEMO O[C@H]1CC[N@@H+](Cc2ccc(CNCc3cccc(Br)c3F)cc2)C1 ZINC000657596455 567074904 /nfs/dbraw/zinc/07/49/04/567074904.db2.gz NHQURHJYFDLQAD-KRWDZBQOSA-N 1 1 393.300 3.445 10 0 GGAEMO Cc1ccc(C(=O)NC[C@H]2C[N@@H+](CC(C)C)CCO2)c(C)c1Br ZINC000682854141 567076283 /nfs/dbraw/zinc/07/62/83/567076283.db2.gz SGPDBCZWEQYPRC-HNNXBMFYSA-N 1 1 383.330 3.153 10 0 GGAEMO CN1CC[C@H]([NH2+]C[C@H](CO)Cc2ccc(F)c(Br)c2)[C@@H]2CCC[C@@H]21 ZINC000453337212 567076480 /nfs/dbraw/zinc/07/64/80/567076480.db2.gz ASGAZJVNAXVXEL-PDWMJMLSSA-N 1 1 399.348 3.202 10 0 GGAEMO FC1(F)C[C@H]1OCC[NH2+]Cc1ncc(Br)cc1Br ZINC000657619804 567077456 /nfs/dbraw/zinc/07/74/56/567077456.db2.gz UORQCGYYXUINMR-SNVBAGLBSA-N 1 1 386.034 3.120 10 0 GGAEMO C[C@H]1CC[C@H]([NH2+]Cc2cc(OC(F)F)ccc2Br)CS1(=O)=O ZINC000657636255 567078236 /nfs/dbraw/zinc/07/82/36/567078236.db2.gz BECRIBJISDZADD-ONGXEEELSA-N 1 1 398.269 3.106 10 0 GGAEMO CCCOc1ccc(Br)cc1C[NH2+][C@@H]1CC[C@H](C)S(=O)(=O)C1 ZINC000657634657 567078631 /nfs/dbraw/zinc/07/86/31/567078631.db2.gz KCWXEQYDDFSBQZ-SWLSCSKDSA-N 1 1 390.343 3.293 10 0 GGAEMO C[C@H]1CC[C@@H]([NH2+]Cc2cc(Br)ccc2OC(F)F)CS1(=O)=O ZINC000657635301 567078905 /nfs/dbraw/zinc/07/89/05/567078905.db2.gz OYDCSPYAQVGORJ-JOYOIKCWSA-N 1 1 398.269 3.106 10 0 GGAEMO Brc1cncc(Br)c1C[NH2+][C@@H]1COC2(CCC2)C1 ZINC000657630577 567079115 /nfs/dbraw/zinc/07/91/15/567079115.db2.gz JUNCUIWKTUKXNK-VIFPVBQESA-N 1 1 376.092 3.408 10 0 GGAEMO Cc1c(Br)c2ccccc2n1CC(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000521778575 567079122 /nfs/dbraw/zinc/07/91/22/567079122.db2.gz ACAZFCRTDKINLA-AWEZNQCLSA-N 1 1 390.325 3.313 10 0 GGAEMO C[C@@H]1CC[C@H]([NH2+]Cc2cc(OC(F)F)ccc2Br)CS1(=O)=O ZINC000657636253 567079235 /nfs/dbraw/zinc/07/92/35/567079235.db2.gz BECRIBJISDZADD-KOLCDFICSA-N 1 1 398.269 3.106 10 0 GGAEMO Cc1ccc(C(=O)NCC2CCN(CC[NH+](C)C)CC2)c(C)c1Br ZINC000682899643 567081162 /nfs/dbraw/zinc/08/11/62/567081162.db2.gz NWVWMLTUAKGFDV-UHFFFAOYSA-N 1 1 396.373 3.069 10 0 GGAEMO CC[NH+]1CCN(CCCCNC(=O)c2ccc(C)c(Br)c2C)CC1 ZINC000682900192 567081502 /nfs/dbraw/zinc/08/15/02/567081502.db2.gz VDFREMZQOWSJQZ-UHFFFAOYSA-N 1 1 396.373 3.213 10 0 GGAEMO O=C(CCc1cc(Br)ccc1F)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614091053 567082347 /nfs/dbraw/zinc/08/23/47/567082347.db2.gz CFHCCXMKENOEHF-HZPDHXFCSA-N 1 1 387.268 3.166 10 0 GGAEMO CC(C)(C)n1nnc(C[NH2+]CC2(Cc3ccc(Br)cc3)CC2)n1 ZINC000657660078 567082413 /nfs/dbraw/zinc/08/24/13/567082413.db2.gz FIHQBJNZXUOBPO-UHFFFAOYSA-N 1 1 378.318 3.303 10 0 GGAEMO O=C(CCc1cccc(F)c1Br)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614088507 567082436 /nfs/dbraw/zinc/08/24/36/567082436.db2.gz CIFATMUFXKKKAO-GJZGRUSLSA-N 1 1 387.268 3.166 10 0 GGAEMO Cc1ccc(C(=O)NCCCC[N@H+]2CCC[C@@H]2CO)c(C)c1Br ZINC000682922850 567082670 /nfs/dbraw/zinc/08/26/70/567082670.db2.gz UPSWZKRXCSERGS-OAHLLOKOSA-N 1 1 383.330 3.033 10 0 GGAEMO O=C(N1CC[C@H]([NH+]2CCC2)[C@H](F)C1)C1(Cc2ccccc2Br)CC1 ZINC000614088269 567082868 /nfs/dbraw/zinc/08/28/68/567082868.db2.gz ARLFBCRHTGCQMD-SJORKVTESA-N 1 1 395.316 3.417 10 0 GGAEMO O=C(c1cc(Cl)c(Br)cc1F)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614089084 567082995 /nfs/dbraw/zinc/08/29/95/567082995.db2.gz HASRTEVYOJFULQ-ZIAGYGMSSA-N 1 1 393.659 3.500 10 0 GGAEMO O=C(c1ccc(Br)c(Cl)c1F)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614098123 567083620 /nfs/dbraw/zinc/08/36/20/567083620.db2.gz PRFAKUNCSZIXJU-NWDGAFQWSA-N 1 1 393.659 3.500 10 0 GGAEMO Cc1sc(Br)c(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@H](F)C2)c1C ZINC000614097327 567083784 /nfs/dbraw/zinc/08/37/84/567083784.db2.gz GBGNYVOPCRSMHQ-VXGBXAGGSA-N 1 1 375.307 3.386 10 0 GGAEMO COc1cc(Br)ccc1CCC(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614092032 567084063 /nfs/dbraw/zinc/08/40/63/567084063.db2.gz HNDBPNTXAVPUTF-JKSUJKDBSA-N 1 1 399.304 3.035 10 0 GGAEMO C/C(=C/c1cccc(C(F)(F)F)c1)C[N@@H+]1CCCN(S(C)(=O)=O)CC1 ZINC000565624026 567084096 /nfs/dbraw/zinc/08/40/96/567084096.db2.gz AOMBRDKWLPTKOX-KAMYIIQDSA-N 1 1 376.444 3.076 10 0 GGAEMO C/C(=C/c1cccc(C(F)(F)F)c1)C[N@H+]1CCCN(S(C)(=O)=O)CC1 ZINC000565624026 567084102 /nfs/dbraw/zinc/08/41/02/567084102.db2.gz AOMBRDKWLPTKOX-KAMYIIQDSA-N 1 1 376.444 3.076 10 0 GGAEMO O=C(c1ccc(Br)c(Cl)c1F)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614098125 567084150 /nfs/dbraw/zinc/08/41/50/567084150.db2.gz PRFAKUNCSZIXJU-VXGBXAGGSA-N 1 1 393.659 3.500 10 0 GGAEMO O=C(c1cc2cc(Br)sc2[nH]1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614099733 567084236 /nfs/dbraw/zinc/08/42/36/567084236.db2.gz DLUHHVHZNHDRME-CMPLNLGQSA-N 1 1 386.290 3.250 10 0 GGAEMO Cc1sc(Br)c(C(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)c1C ZINC000614097324 567084269 /nfs/dbraw/zinc/08/42/69/567084269.db2.gz GBGNYVOPCRSMHQ-NEPJUHHUSA-N 1 1 375.307 3.386 10 0 GGAEMO O=C(N1CC[C@H]([NH+]2CCC2)[C@H](F)C1)C1(c2cc(F)cc(Br)c2)CC1 ZINC000614096450 567084533 /nfs/dbraw/zinc/08/45/33/567084533.db2.gz CMEYJBNEQJYPGP-CVEARBPZSA-N 1 1 399.279 3.265 10 0 GGAEMO O=C(Cc1c[nH]c2cc(Br)ccc12)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614092788 567084740 /nfs/dbraw/zinc/08/47/40/567084740.db2.gz GXTDQETXFXAKCP-NVXWUHKLSA-N 1 1 394.288 3.118 10 0 GGAEMO C[C@@H](CC(=O)NCc1c[nH+]c(N(C)C)n1C)c1ccc(Br)cc1 ZINC000431491841 567084741 /nfs/dbraw/zinc/08/47/41/567084741.db2.gz ZAKRDSGIPNWSRO-LBPRGKRZSA-N 1 1 379.302 3.059 10 0 GGAEMO CSc1c(C(=O)N(C)C[C@@H]2CC[N@@H+](Cc3ccc(C)s3)C2)cnn1C ZINC000521885641 567084828 /nfs/dbraw/zinc/08/48/28/567084828.db2.gz VWRWGLRDVLXADL-AWEZNQCLSA-N 1 1 378.567 3.106 10 0 GGAEMO O=C(CCCc1cccc(Br)c1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614093013 567085082 /nfs/dbraw/zinc/08/50/82/567085082.db2.gz HVBDFGJIABBQLY-IAGOWNOFSA-N 1 1 383.305 3.417 10 0 GGAEMO O=C(Cc1c(Cl)cccc1Br)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614102066 567085781 /nfs/dbraw/zinc/08/57/81/567085781.db2.gz FRPLDHUROROTBE-HUUCEWRRSA-N 1 1 389.696 3.290 10 0 GGAEMO O=C(CCOc1cccc(Cl)c1Cl)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614103854 567085835 /nfs/dbraw/zinc/08/58/35/567085835.db2.gz UEIYVWKJUGLXOK-KGLIPLIRSA-N 1 1 375.271 3.407 10 0 GGAEMO O=C(c1c(Cl)cccc1Br)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614106110 567085989 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CC[N@H+]1CC[C@H](CNCc2c(F)ccc(I)c2F)C1 ZINC000474490834 567176509 /nfs/dbraw/zinc/17/65/09/567176509.db2.gz PDRRUDJHZBTARE-SNVBAGLBSA-N 1 1 380.220 3.001 10 0 GGAEMO CC[N@H+]1CC[C@@H](CNCc2c(F)ccc(I)c2F)C1 ZINC000474490832 567176807 /nfs/dbraw/zinc/17/68/07/567176807.db2.gz PDRRUDJHZBTARE-JTQLQIEISA-N 1 1 380.220 3.001 10 0 GGAEMO Cc1nc(CS(=O)(=O)NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)cs1 ZINC000684101322 567178055 /nfs/dbraw/zinc/17/80/55/567178055.db2.gz ZYOSIKWHIIIDOD-CJNGLKHVSA-N 1 1 385.580 3.016 10 0 GGAEMO Cc1nc(CNC(=O)NC[C@H](C)[N@H+]2CCC[C@@H](C)C2)sc1Br ZINC000454492811 567178450 /nfs/dbraw/zinc/17/84/50/567178450.db2.gz ABCIDTBTPRNIRW-MNOVXSKESA-N 1 1 389.363 3.134 10 0 GGAEMO CCC[C@H](C)[C@H](CO)[NH2+]Cc1nc(Cc2cccc(Br)c2)no1 ZINC000566681560 567180438 /nfs/dbraw/zinc/18/04/38/567180438.db2.gz INCADTHZEDXNFX-WFASDCNBSA-N 1 1 382.302 3.310 10 0 GGAEMO CC[C@H]1C[N@H+](C)CCN1C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000615379718 567181755 /nfs/dbraw/zinc/18/17/55/567181755.db2.gz 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O=C(c1cccc(Br)c1Cl)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000684180531 567185491 /nfs/dbraw/zinc/18/54/91/567185491.db2.gz XPBAEJNHBXMZRI-CHWSQXEVSA-N 1 1 375.669 3.361 10 0 GGAEMO O=C(c1cc2cc(Br)ccc2[nH]1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000684183184 567186137 /nfs/dbraw/zinc/18/61/37/567186137.db2.gz NEOJLMWCVMHTNE-CJNGLKHVSA-N 1 1 380.261 3.189 10 0 GGAEMO CC[N@H+]1C[C@@H](C)N(C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C[C@H]1C ZINC000498567226 567186350 /nfs/dbraw/zinc/18/63/50/567186350.db2.gz MSCVLSJJTBSYIQ-VXGBXAGGSA-N 1 1 392.297 3.258 10 0 GGAEMO O=C(c1cc2cc(Br)ccc2o1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000684184977 567186847 /nfs/dbraw/zinc/18/68/47/567186847.db2.gz IQBILFDXFLCSNP-UONOGXRCSA-N 1 1 381.245 3.454 10 0 GGAEMO O=C(c1cc2cc(Br)ccc2[nH]1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000684183182 567186948 /nfs/dbraw/zinc/18/69/48/567186948.db2.gz NEOJLMWCVMHTNE-BBRMVZONSA-N 1 1 380.261 3.189 10 0 GGAEMO O=C(CCc1cc(F)ccc1Br)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000684185688 567187322 /nfs/dbraw/zinc/18/73/22/567187322.db2.gz YRSYNLZQOXTCOR-CVEARBPZSA-N 1 1 387.268 3.166 10 0 GGAEMO O=C(c1cc(Br)ccc1Cl)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000684185562 567187591 /nfs/dbraw/zinc/18/75/91/567187591.db2.gz YGYGROPKJFIVAS-KBPBESRZSA-N 1 1 375.669 3.361 10 0 GGAEMO CC[N@H+]1C[C@H](C)N(C(=O)c2ccc(C)c(I)c2)C[C@@H]1C ZINC000498570883 567188073 /nfs/dbraw/zinc/18/80/73/567188073.db2.gz HVZZHORZYGJVHJ-STQMWFEESA-N 1 1 386.277 3.154 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)Cc2c(Br)cccc2C(=O)OC)[C@H](C)C1 ZINC000432772303 567188277 /nfs/dbraw/zinc/18/82/77/567188277.db2.gz SJWSEGYEPUVJNA-CXAGYDPISA-N 1 1 383.330 3.398 10 0 GGAEMO Cc1ccccc1OCCNC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659252275 567193290 /nfs/dbraw/zinc/19/32/90/567193290.db2.gz XQLCYWVJDOLUIC-UHFFFAOYSA-N 1 1 381.295 3.231 10 0 GGAEMO CCOc1ccccc1CCNC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659254082 567193343 /nfs/dbraw/zinc/19/33/43/567193343.db2.gz GQOKINZXPBSHNJ-UHFFFAOYSA-N 1 1 395.322 3.485 10 0 GGAEMO C[C@@H](CNC(=O)c1sc2c(c1Br)C[NH2+]C2)Oc1ccccc1F ZINC000659252022 567193354 /nfs/dbraw/zinc/19/33/54/567193354.db2.gz LTKDUYRZOAMLNN-VIFPVBQESA-N 1 1 399.285 3.450 10 0 GGAEMO C[C@@H](CNC(=O)c1sc2c(c1Br)C[NH2+]C2)Oc1cccc(F)c1 ZINC000659251663 567193496 /nfs/dbraw/zinc/19/34/96/567193496.db2.gz HAZHMZSOXSDGGS-VIFPVBQESA-N 1 1 399.285 3.450 10 0 GGAEMO O=C(Nc1ccc2c(c1)OCCO2)c1sc2c(c1Br)C[NH2+]C2 ZINC000659249338 567193815 /nfs/dbraw/zinc/19/38/15/567193815.db2.gz FLIWDZFRFXECJE-UHFFFAOYSA-N 1 1 381.251 3.137 10 0 GGAEMO CN(CCOCc1ccccc1)C(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659246200 567194138 /nfs/dbraw/zinc/19/41/38/567194138.db2.gz GYLSZIPWUOERAS-UHFFFAOYSA-N 1 1 395.322 3.403 10 0 GGAEMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)Cc1noc3ccc(Br)cc31)C2 ZINC000615608021 567194185 /nfs/dbraw/zinc/19/41/85/567194185.db2.gz PZVWTWRVOUNEAI-SFHVURJKSA-N 1 1 392.297 3.077 10 0 GGAEMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)[C@@H]1CCc3cc(Br)ccc31)C2 ZINC000615609579 567194516 /nfs/dbraw/zinc/19/45/16/567194516.db2.gz 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392.256 3.138 10 0 GGAEMO C[N@@H+](CC(=O)NCC1(Cc2ccc(Br)cc2)CC1)[C@H]1CCSC1 ZINC000618537086 567396900 /nfs/dbraw/zinc/39/69/00/567396900.db2.gz CPLDAUKYWKBOFF-INIZCTEOSA-N 1 1 397.382 3.325 10 0 GGAEMO O=S1(=O)C[C@H](C[NH2+]Cc2ccc(F)c(Cl)c2Cl)Oc2ccccc21 ZINC000569339350 567397464 /nfs/dbraw/zinc/39/74/64/567397464.db2.gz DKEDMKFZRXNWAF-NSHDSACASA-N 1 1 390.263 3.457 10 0 GGAEMO Cc1cccc(CNC(=O)C[NH2+][C@H]2CCOc3c(Br)cccc32)c1 ZINC000501582288 567397800 /nfs/dbraw/zinc/39/78/00/567397800.db2.gz SSTCUJNDXZEIDK-KRWDZBQOSA-N 1 1 389.293 3.487 10 0 GGAEMO C[C@@H](C(=O)N(C)Cc1ccc(Br)cc1)[N@H+]1CC[C@@H](C)O[C@@H](C)C1 ZINC000661858170 567398793 /nfs/dbraw/zinc/39/87/93/567398793.db2.gz ZKPIRLICOQWLSD-ILXRZTDVSA-N 1 1 383.330 3.295 10 0 GGAEMO COc1ccccc1[C@@H]([NH3+])C(=O)N1CCc2cc(Br)cc(C)c2C1 ZINC000569364754 567400018 /nfs/dbraw/zinc/40/00/18/567400018.db2.gz WXLMCNIBSOWRAQ-GOSISDBHSA-N 1 1 389.293 3.351 10 0 GGAEMO CN(C)S(=O)(=O)[C@@H]1CCC[N@H+](CCCc2c(Cl)cccc2Cl)C1 ZINC000569392567 567400801 /nfs/dbraw/zinc/40/08/01/567400801.db2.gz QBBCFICWHFICHG-CYBMUJFWSA-N 1 1 379.353 3.282 10 0 GGAEMO CN(C)S(=O)(=O)[C@@H]1CCC[N@@H+](CCCc2c(Cl)cccc2Cl)C1 ZINC000569392567 567400807 /nfs/dbraw/zinc/40/08/07/567400807.db2.gz QBBCFICWHFICHG-CYBMUJFWSA-N 1 1 379.353 3.282 10 0 GGAEMO OCC[N@H+](Cc1cc(Br)cs1)C[C@@H](O)Cc1ccc(F)cc1 ZINC000549610491 567401644 /nfs/dbraw/zinc/40/16/44/567401644.db2.gz NKNKYNRJUFMBOY-HNNXBMFYSA-N 1 1 388.302 3.048 10 0 GGAEMO CSc1ccc([C@@H](CNS(=O)(=O)c2nc(C)c(C)s2)[NH+](C)C)cc1 ZINC000549630332 567401716 /nfs/dbraw/zinc/40/17/16/567401716.db2.gz ODTLSMBKBWKVEG-OAHLLOKOSA-N 1 1 385.580 3.063 10 0 GGAEMO Brc1ccc([C@@H]2CC[N@@H+]2CCc2nnnn2-c2ccccc2)cc1 ZINC000662093588 567409213 /nfs/dbraw/zinc/40/92/13/567409213.db2.gz FJDGEMPVYGREOZ-KRWDZBQOSA-N 1 1 384.281 3.414 10 0 GGAEMO Brc1ccc([C@@H]2CC[N@H+]2CCc2nnnn2-c2ccccc2)cc1 ZINC000662093588 567409221 /nfs/dbraw/zinc/40/92/21/567409221.db2.gz FJDGEMPVYGREOZ-KRWDZBQOSA-N 1 1 384.281 3.414 10 0 GGAEMO CN(C(=O)N[C@H]1CCc2c1cccc2Br)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000477689519 567409261 /nfs/dbraw/zinc/40/92/61/567409261.db2.gz JBZNZZQRZLARHQ-DYVFJYSZSA-N 1 1 378.314 3.315 10 0 GGAEMO O[C@H](COc1ccc(Br)cc1F)C[N@H+]1CCc2ccccc2C1 ZINC000549784444 567410486 /nfs/dbraw/zinc/41/04/86/567410486.db2.gz ACHJSYXPYWRWII-INIZCTEOSA-N 1 1 380.257 3.386 10 0 GGAEMO C[N@@H+](Cc1ccccc1)C1CN(C(=O)c2cc(Br)cc3nc[nH]c32)C1 ZINC000569518921 567411018 /nfs/dbraw/zinc/41/10/18/567411018.db2.gz UYMSMLZROSUGFS-UHFFFAOYSA-N 1 1 399.292 3.282 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)CCc1nc2cc(Cl)ccc2s1 ZINC000593415984 567411761 /nfs/dbraw/zinc/41/17/61/567411761.db2.gz AQBRHBCPFGSEIV-CQSZACIVSA-N 1 1 381.929 3.109 10 0 GGAEMO O[C@H]1CC[N@H+](C2CCN([C@@H]3CCCc4ccc(Br)cc43)CC2)C1 ZINC000662153169 567411957 /nfs/dbraw/zinc/41/19/57/567411957.db2.gz ORYOZQYJINKNFV-PKOBYXMFSA-N 1 1 379.342 3.358 10 0 GGAEMO FC(F)(F)COCCC[NH+]1CCN(c2ncc(C(F)(F)F)s2)CC1 ZINC000477726237 567413029 /nfs/dbraw/zinc/41/30/29/567413029.db2.gz SHJVBMCUSCCTHO-UHFFFAOYSA-N 1 1 377.354 3.253 10 0 GGAEMO Cc1cc(Br)c(CN2CCC([N@H+]3CC[C@@H](O)C3)CC2)cc1Cl ZINC000662150318 567413398 /nfs/dbraw/zinc/41/33/98/567413398.db2.gz UWMBKGRVZNADDO-OAHLLOKOSA-N 1 1 387.749 3.442 10 0 GGAEMO OC[C@@H]([NH2+]C[C@@H](O)COc1c(Cl)cccc1Cl)c1ccc(F)cc1F ZINC000662163014 567414327 /nfs/dbraw/zinc/41/43/27/567414327.db2.gz UBWOFSOIFJVCSR-BDJLRTHQSA-N 1 1 392.229 3.335 10 0 GGAEMO CN1C(=O)C[C@@H](Nc2cc[nH+]cc2Br)[C@@H]1c1ccc(Cl)cc1 ZINC000501991168 567414605 /nfs/dbraw/zinc/41/46/05/567414605.db2.gz VPGWVOFCJVUQBF-ZBFHGGJFSA-N 1 1 380.673 3.303 10 0 GGAEMO Brc1ccccc1-n1nnnc1C[N@@H+](CCC1CC1)CC1CC1 ZINC000662179148 567414765 /nfs/dbraw/zinc/41/47/65/567414765.db2.gz JSTONVQEPQTNHM-UHFFFAOYSA-N 1 1 376.302 3.437 10 0 GGAEMO O[C@@H]1CC[N@H+](C2CCN(Cc3cc(Br)cc4cccnc43)CC2)C1 ZINC000662155464 567414803 /nfs/dbraw/zinc/41/48/03/567414803.db2.gz JDWHAJPJWLFMEM-GOSISDBHSA-N 1 1 390.325 3.028 10 0 GGAEMO CCC[N@@H+](C)CC(C)(C)NCC(=O)N(C)Cc1ccccc1Br ZINC000662173898 567414925 /nfs/dbraw/zinc/41/49/25/567414925.db2.gz TUFMJPSRXCNHPI-UHFFFAOYSA-N 1 1 384.362 3.118 10 0 GGAEMO CCCN(C)CC(C)(C)[NH2+]CC(=O)N(C)Cc1ccccc1Br ZINC000662173898 567414928 /nfs/dbraw/zinc/41/49/28/567414928.db2.gz TUFMJPSRXCNHPI-UHFFFAOYSA-N 1 1 384.362 3.118 10 0 GGAEMO OC[C@@H]([NH2+]C[C@H](O)COc1c(Cl)cccc1Cl)c1ccc(F)cc1F ZINC000662163017 567414994 /nfs/dbraw/zinc/41/49/94/567414994.db2.gz UBWOFSOIFJVCSR-MEDUHNTESA-N 1 1 392.229 3.335 10 0 GGAEMO Cc1ccc2c(c1Br)CN(CCC[NH+]1CCN(C(C)C)CC1)C2 ZINC000662192810 567415892 /nfs/dbraw/zinc/41/58/92/567415892.db2.gz VADBOEKIZXGOAV-UHFFFAOYSA-N 1 1 380.374 3.489 10 0 GGAEMO Brc1ccc(Cn2cc(C[NH2+][C@H]3CCc4ccccc43)nn2)nc1 ZINC000641146840 567416697 /nfs/dbraw/zinc/41/66/97/567416697.db2.gz RPICETOHLWQOOZ-SFHVURJKSA-N 1 1 384.281 3.261 10 0 GGAEMO Brc1cnccc1Cn1cc(C[NH2+][C@H]2CCc3ccccc32)nn1 ZINC000641156843 567417297 /nfs/dbraw/zinc/41/72/97/567417297.db2.gz GXOOUMZOCGOHII-SFHVURJKSA-N 1 1 384.281 3.261 10 0 GGAEMO C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)NC[C@@H]1CCC[N@H+]1C ZINC000502124580 567420455 /nfs/dbraw/zinc/42/04/55/567420455.db2.gz CNBXVBIVKLGDMM-PWSUYJOCSA-N 1 1 375.694 3.080 10 0 GGAEMO CN(CC[N@@H+](C)C1CCN(C)CC1)Cc1ccc(Br)c(F)c1F ZINC000528423547 567421851 /nfs/dbraw/zinc/42/18/51/567421851.db2.gz OBLVVMCOXYEJIA-UHFFFAOYSA-N 1 1 390.316 3.185 10 0 GGAEMO CN(CCN(C)C1CC[NH+](C)CC1)Cc1ccc(Br)c(F)c1F ZINC000528423547 567421857 /nfs/dbraw/zinc/42/18/57/567421857.db2.gz OBLVVMCOXYEJIA-UHFFFAOYSA-N 1 1 390.316 3.185 10 0 GGAEMO COc1ccc(Br)cc1[C@H]1CCCN1C[C@@H]1CCC2(C[NH2+]C2)O1 ZINC000662255202 567422042 /nfs/dbraw/zinc/42/20/42/567422042.db2.gz BCPVBNADHVJMPG-GOEBONIOSA-N 1 1 381.314 3.116 10 0 GGAEMO CN(C[C@@H]1CC[N@@H+](C)C1)C(=O)c1scc(Br)c1Br ZINC000528431138 567422917 /nfs/dbraw/zinc/42/29/17/567422917.db2.gz HJRGNNXRKYRVBD-MRVPVSSYSA-N 1 1 396.148 3.297 10 0 GGAEMO O=C(c1scc(Br)c1Br)N1CC[N@H+]2CCC[C@H]2C1 ZINC000528439028 567423163 /nfs/dbraw/zinc/42/31/63/567423163.db2.gz CDAQLUOXBRRQBV-QMMMGPOBSA-N 1 1 394.132 3.193 10 0 GGAEMO Cc1cc(Br)ccc1NC(=O)CN1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000662297561 567426074 /nfs/dbraw/zinc/42/60/74/567426074.db2.gz RHFPBSZPEYDBJX-INIZCTEOSA-N 1 1 394.357 3.408 10 0 GGAEMO Brc1ccc([C@H]2CCC[N@@H+]2CCc2nnnn2-c2ccccc2)nc1 ZINC000550078095 567426070 /nfs/dbraw/zinc/42/60/70/567426070.db2.gz RAKCGBPJDWVDDA-QGZVFWFLSA-N 1 1 399.296 3.199 10 0 GGAEMO Brc1ccc([C@H]2CCC[N@H+]2CCc2nnnn2-c2ccccc2)nc1 ZINC000550078095 567426072 /nfs/dbraw/zinc/42/60/72/567426072.db2.gz RAKCGBPJDWVDDA-QGZVFWFLSA-N 1 1 399.296 3.199 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2cnc3c(Br)cccn23)[C@@H](C)C1 ZINC000436490624 567428408 /nfs/dbraw/zinc/42/84/08/567428408.db2.gz QLNPUKXMQGSCOJ-JSGCOSHPSA-N 1 1 394.317 3.291 10 0 GGAEMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1Cc1ccc(Br)c(F)c1F ZINC000528480967 567428811 /nfs/dbraw/zinc/42/88/11/567428811.db2.gz NLFADKNOIBCOHD-GFCCVEGCSA-N 1 1 389.284 3.412 10 0 GGAEMO C/C(=C/c1ccccc1C(F)(F)F)C[N@H+]1CCC[C@H](CS(N)(=O)=O)C1 ZINC000502344836 567429284 /nfs/dbraw/zinc/42/92/84/567429284.db2.gz KAVKTFBEEOFTMW-XXYUJHKVSA-N 1 1 376.444 3.109 10 0 GGAEMO COc1ccc(NC(=O)CC[N@@H+]2C[C@H](C)O[C@@](C)(C(F)F)C2)cc1Cl ZINC000662362559 567429766 /nfs/dbraw/zinc/42/97/66/567429766.db2.gz QHMOUXHWMAZILB-APPDUMDISA-N 1 1 376.831 3.422 10 0 GGAEMO COc1ccc(NC(=O)CC[N@H+]2C[C@H](C)O[C@@](C)(C(F)F)C2)cc1Cl ZINC000662362559 567429772 /nfs/dbraw/zinc/42/97/72/567429772.db2.gz QHMOUXHWMAZILB-APPDUMDISA-N 1 1 376.831 3.422 10 0 GGAEMO COc1ccc(NC(=O)CC[N@@H+]2C[C@@H](C)O[C@](C)(C(F)F)C2)cc1Cl ZINC000662362562 567429947 /nfs/dbraw/zinc/42/99/47/567429947.db2.gz QHMOUXHWMAZILB-DIFFPNOSSA-N 1 1 376.831 3.422 10 0 GGAEMO COc1ccc(NC(=O)CC[N@H+]2C[C@@H](C)O[C@](C)(C(F)F)C2)cc1Cl ZINC000662362562 567429951 /nfs/dbraw/zinc/42/99/51/567429951.db2.gz QHMOUXHWMAZILB-DIFFPNOSSA-N 1 1 376.831 3.422 10 0 GGAEMO O=C(CCOc1ccccc1Br)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000456986947 567430475 /nfs/dbraw/zinc/43/04/75/567430475.db2.gz JWEYABCXSDSBEE-QGZVFWFLSA-N 1 1 389.293 3.391 10 0 GGAEMO O=C(CCOc1ccccc1Br)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000456986945 567430498 /nfs/dbraw/zinc/43/04/98/567430498.db2.gz JWEYABCXSDSBEE-KRWDZBQOSA-N 1 1 389.293 3.391 10 0 GGAEMO CC(C)c1n[nH]c(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)c1Br ZINC000457003145 567431669 /nfs/dbraw/zinc/43/16/69/567431669.db2.gz XFYQCIKYKHPMHA-CYBMUJFWSA-N 1 1 377.286 3.082 10 0 GGAEMO O=C(N1CC[NH2+][C@H](c2ccccc2)C1)C1(c2cncc(Br)c2)CC1 ZINC000457014333 567431815 /nfs/dbraw/zinc/43/18/15/567431815.db2.gz HXPJLOVDESBQOE-KRWDZBQOSA-N 1 1 386.293 3.049 10 0 GGAEMO O=C(Cc1cc(Br)ccc1F)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000457030888 567433211 /nfs/dbraw/zinc/43/32/11/567433211.db2.gz RZNJQOIVQKZGNN-KRWDZBQOSA-N 1 1 377.257 3.304 10 0 GGAEMO O=[S@]1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1 ZINC000593688397 567434017 /nfs/dbraw/zinc/43/40/17/567434017.db2.gz PBCFSTFZKLQVCG-KDGREJDFSA-N 1 1 387.345 3.264 10 0 GGAEMO O=[S@]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1 ZINC000593688397 567434024 /nfs/dbraw/zinc/43/40/24/567434024.db2.gz PBCFSTFZKLQVCG-KDGREJDFSA-N 1 1 387.345 3.264 10 0 GGAEMO CC[C@H](C)C(=O)N1CSC[C@@H]1C(=O)Nc1ccc(C[NH+](C)C)c(Cl)c1 ZINC000478045333 567434562 /nfs/dbraw/zinc/43/45/62/567434562.db2.gz JPRGATRJNMBUNF-BLLLJJGKSA-N 1 1 383.945 3.288 10 0 GGAEMO C[C@@H]1C[C@H](S(=O)(=O)N[C@@H](C[NH+](C)C)c2ccc(Cl)c(Cl)c2)CCO1 ZINC000528548905 567435642 /nfs/dbraw/zinc/43/56/42/567435642.db2.gz RNKNLYWKPBIMQO-KFNAQCHYSA-N 1 1 395.352 3.083 10 0 GGAEMO Cc1ccc2c(c1C)OC[C@@H]2NC(=O)[C@H]([NH3+])c1ccccc1Br ZINC000662443619 567436377 /nfs/dbraw/zinc/43/63/77/567436377.db2.gz UJGUWVVOKZAHQG-JKSUJKDBSA-N 1 1 375.266 3.316 10 0 GGAEMO O=S(=O)(Cc1ccccc1C(F)(F)F)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000528555093 567437173 /nfs/dbraw/zinc/43/71/73/567437173.db2.gz VQTPSMNEVFRTDT-HNNXBMFYSA-N 1 1 376.444 3.142 10 0 GGAEMO C[NH+](C)C[C@@H](NS(=O)(=O)c1ccccc1N)c1ccc(Cl)c(Cl)c1 ZINC000528552522 567437603 /nfs/dbraw/zinc/43/76/03/567437603.db2.gz ZTBUYZKZALZWDJ-OAHLLOKOSA-N 1 1 388.320 3.157 10 0 GGAEMO COc1ccccc1CCN(C)C(=O)[C@@H]([NH3+])c1ccccc1Br ZINC000662445193 567437904 /nfs/dbraw/zinc/43/79/04/567437904.db2.gz FKZFHXBHILEDBT-KRWDZBQOSA-N 1 1 377.282 3.159 10 0 GGAEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1sc2c(c1Br)CNC2 ZINC000662450227 567437951 /nfs/dbraw/zinc/43/79/51/567437951.db2.gz LFXDIWBJZOBTOY-PHIMTYICSA-N 1 1 386.359 3.107 10 0 GGAEMO C[N@H+]1CCC[C@H]1CNC(=O)c1scc(Br)c1Br ZINC000528563514 567438357 /nfs/dbraw/zinc/43/83/57/567438357.db2.gz ZEYBMYQFCAKRBQ-ZETCQYMHSA-N 1 1 382.121 3.097 10 0 GGAEMO O=C(NCCCCNc1ccccn1)c1sc2c(c1Br)C[NH2+]C2 ZINC000662447064 567438549 /nfs/dbraw/zinc/43/85/49/567438549.db2.gz UJLPKYMFPAZQTB-UHFFFAOYSA-N 1 1 395.326 3.131 10 0 GGAEMO C[C@@H]1C[N@H+](CCO)CCN1C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl ZINC000457099316 567440154 /nfs/dbraw/zinc/44/01/54/567440154.db2.gz MPRYNDUYPGOIBP-GFCCVEGCSA-N 1 1 382.291 3.127 10 0 GGAEMO C[C@@H]1C[N@@H+](CCO)CCN1C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl ZINC000457099316 567440159 /nfs/dbraw/zinc/44/01/59/567440159.db2.gz MPRYNDUYPGOIBP-GFCCVEGCSA-N 1 1 382.291 3.127 10 0 GGAEMO CC(C)[N@H+]1CC[C@@H](N(C)C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C1 ZINC000457115198 567441492 /nfs/dbraw/zinc/44/14/92/567441492.db2.gz KTPNWJWCSLHTHZ-CYBMUJFWSA-N 1 1 392.297 3.258 10 0 GGAEMO [NH3+][C@H](C(=O)N1CCO[C@H](c2ccsc2)C1)c1ccccc1Br ZINC000662499525 567441480 /nfs/dbraw/zinc/44/14/80/567441480.db2.gz UOFVEDKHTRMLLF-GJZGRUSLSA-N 1 1 381.295 3.111 10 0 GGAEMO O=C(NCCC[C@@H]1CCCC[C@H]1O)c1sc2c(c1Br)C[NH2+]C2 ZINC000662504288 567443075 /nfs/dbraw/zinc/44/30/75/567443075.db2.gz DKDNHSOCXVKXBS-CMPLNLGQSA-N 1 1 387.343 3.175 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc(C(F)(F)F)cc3Cl)[C@H]2C1 ZINC000502589738 567443574 /nfs/dbraw/zinc/44/35/74/567443574.db2.gz VNDPMINGJXPUEJ-LSDHHAIUSA-N 1 1 376.806 3.294 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)[C@H]3C[C@@H]3c3ccc(Cl)cc3Cl)[C@H]2C1 ZINC000502567455 567443642 /nfs/dbraw/zinc/44/36/42/567443642.db2.gz BIZDDSPCONWQGE-MXSMSXNCSA-N 1 1 383.319 3.419 10 0 GGAEMO COc1ccc(Br)cc1C[N@H+]1CC2(CCOCC2)CC[C@H]1CO ZINC000528642444 567444216 /nfs/dbraw/zinc/44/42/16/567444216.db2.gz YEMNHYNCVSTUES-INIZCTEOSA-N 1 1 384.314 3.211 10 0 GGAEMO O=C(N[C@@H]1C[C@]1(F)c1ccccc1)c1sc2c(c1Br)C[NH2+]C2 ZINC000662520573 567444376 /nfs/dbraw/zinc/44/43/76/567444376.db2.gz BSXJBCRATLCIMT-WBMJQRKESA-N 1 1 381.270 3.481 10 0 GGAEMO OC[C@H]1CCC2(CCOCC2)C[N@H+]1CCOc1ccc(Br)cc1 ZINC000528637279 567444439 /nfs/dbraw/zinc/44/44/39/567444439.db2.gz GEWUOKZQVPIJSI-MRXNPFEDSA-N 1 1 384.314 3.081 10 0 GGAEMO COc1cc(C(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)cc(OC)c1Br ZINC000593876440 567444455 /nfs/dbraw/zinc/44/44/55/567444455.db2.gz XYNGUOWDEJBOOC-BETUJISGSA-N 1 1 399.329 3.459 10 0 GGAEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)CNC(=O)c1ccc(Cl)c(Cl)c1 ZINC000593876403 567445315 /nfs/dbraw/zinc/44/53/15/567445315.db2.gz WJBINPUXOSGSST-BETUJISGSA-N 1 1 386.323 3.102 10 0 GGAEMO 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395.297 3.298 10 0 GGAEMO CC(C)(C(=O)N[C@H]1CCc2nc[nH]c2C1)[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000528870623 567464336 /nfs/dbraw/zinc/46/43/36/567464336.db2.gz KTTXIUCCXOYJOE-XJKSGUPXSA-N 1 1 382.291 3.450 10 0 GGAEMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000503024913 567464622 /nfs/dbraw/zinc/46/46/22/567464622.db2.gz RBYDAVPSHLFJCS-NSHDSACASA-N 1 1 375.257 3.070 10 0 GGAEMO COc1cccc(NC(=O)C[C@H](C)[NH2+][C@H](C)c2ncc(Br)cn2)c1 ZINC000550831244 567464844 /nfs/dbraw/zinc/46/48/44/567464844.db2.gz URFWQWORQXSBHI-NWDGAFQWSA-N 1 1 393.285 3.316 10 0 GGAEMO COc1cccc(NC(=O)C[C@@H](C)[NH2+][C@H](C)c2ncc(Br)cn2)c1 ZINC000550831246 567465212 /nfs/dbraw/zinc/46/52/12/567465212.db2.gz URFWQWORQXSBHI-VXGBXAGGSA-N 1 1 393.285 3.316 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000503026639 567465548 /nfs/dbraw/zinc/46/55/48/567465548.db2.gz NYLNMGJGCOIFJQ-MLGOLLRUSA-N 1 1 386.323 3.391 10 0 GGAEMO C[C@H]1CCCN(S(=O)(=O)NC[C@@H](c2ccccc2Cl)[NH+]2CCCC2)C1 ZINC000642099626 567467450 /nfs/dbraw/zinc/46/74/50/567467450.db2.gz ZRPRCHQTPPXHOM-YJBOKZPZSA-N 1 1 385.961 3.043 10 0 GGAEMO CC(C)[N@H+]1CCC[C@H](NC(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000503067049 567468211 /nfs/dbraw/zinc/46/82/11/567468211.db2.gz ZRLQBAXIKKBSSS-NSHDSACASA-N 1 1 375.257 3.259 10 0 GGAEMO C[N@H+]1CC[C@H](NC(=O)c2cc(O)cc(Br)c2)[C@H]1c1ccccc1 ZINC000528912356 567468495 /nfs/dbraw/zinc/46/84/95/567468495.db2.gz GCJUSKMEBSRSSN-DLBZAZTESA-N 1 1 375.266 3.330 10 0 GGAEMO COC[C@H]([NH2+]CC(=O)N1CCC[C@@H](C(F)(F)F)C1)c1cccc(Cl)c1 ZINC000570244511 567468475 /nfs/dbraw/zinc/46/84/75/567468475.db2.gz OEDHUGOVJIBPBH-HIFRSBDPSA-N 1 1 378.822 3.418 10 0 GGAEMO COC[C@H]([NH2+]CC(=O)N1CCC[C@H](C(F)(F)F)C1)c1cccc(Cl)c1 ZINC000570244515 567468942 /nfs/dbraw/zinc/46/89/42/567468942.db2.gz OEDHUGOVJIBPBH-ZFWWWQNUSA-N 1 1 378.822 3.418 10 0 GGAEMO C[C@H](CNC(=O)c1cc(Br)cc2nc[nH]c21)C[NH+]1CCCCC1 ZINC000503129206 567469688 /nfs/dbraw/zinc/46/96/88/567469688.db2.gz FFPPKSCLUGKHSS-GFCCVEGCSA-N 1 1 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GGAEMO C[C@@H](Cn1cc(Br)ccc1=O)[NH2+]CCC[N@@H+](C)C1CCCCC1 ZINC000551268061 567491875 /nfs/dbraw/zinc/49/18/75/567491875.db2.gz YINRDYUHQYJDRZ-HNNXBMFYSA-N 1 1 384.362 3.244 10 0 GGAEMO C[C@@H](Cn1cc(Br)ccc1=O)NCCC[N@H+](C)C1CCCCC1 ZINC000551268061 567491882 /nfs/dbraw/zinc/49/18/82/567491882.db2.gz YINRDYUHQYJDRZ-HNNXBMFYSA-N 1 1 384.362 3.244 10 0 GGAEMO C[C@@H](Cn1cc(Br)ccc1=O)NCCC[N@@H+](C)C1CCCCC1 ZINC000551268061 567491888 /nfs/dbraw/zinc/49/18/88/567491888.db2.gz YINRDYUHQYJDRZ-HNNXBMFYSA-N 1 1 384.362 3.244 10 0 GGAEMO Brc1ccc2[nH+]ccc(N[C@H]3CCCN(c4ncccn4)C3)c2c1 ZINC000503537787 567492837 /nfs/dbraw/zinc/49/28/37/567492837.db2.gz SMVDZDKHFYSGAS-AWEZNQCLSA-N 1 1 384.281 3.290 10 0 GGAEMO C[NH+]1CCN(C(=O)Nc2csc(-c3ccc(Br)cc3)n2)CC1 ZINC000529168329 567492873 /nfs/dbraw/zinc/49/28/73/567492873.db2.gz BRFODPDPFOEPNP-UHFFFAOYSA-N 1 1 381.299 3.352 10 0 GGAEMO C[N@H+]1CCN(C(=O)Cc2ccc(Br)cc2O)C2(CCCCC2)C1 ZINC000551276040 567494090 /nfs/dbraw/zinc/49/40/90/567494090.db2.gz 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387.268 3.213 10 0 GGAEMO C[N@H+]1CCC[C@@H]2CN(C(=O)Cc3c(F)ccc(Br)c3F)CC[C@@H]21 ZINC000503715451 567504022 /nfs/dbraw/zinc/50/40/22/567504022.db2.gz IERXPMVVMDQIEN-ABAIWWIYSA-N 1 1 387.268 3.213 10 0 GGAEMO CC(C)[N@@H+]1CC[C@H](NC(=O)[C@H](N)C(F)(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000570680067 567504623 /nfs/dbraw/zinc/50/46/23/567504623.db2.gz IYPYZTIPMZQXGH-IHRRRGAJSA-N 1 1 381.801 3.009 10 0 GGAEMO CC(C)[N@H+]1CC[C@H](NC(=O)[C@H](N)C(F)(F)F)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000570680067 567504628 /nfs/dbraw/zinc/50/46/28/567504628.db2.gz IYPYZTIPMZQXGH-IHRRRGAJSA-N 1 1 381.801 3.009 10 0 GGAEMO C[N@H+]1CCC[C@@H](CCNC(=O)N[C@@H]2CCc3cc(Br)ccc32)C1 ZINC000457940366 567506689 /nfs/dbraw/zinc/50/66/89/567506689.db2.gz IHEIHFFPVGOGTR-SUMWQHHRSA-N 1 1 380.330 3.468 10 0 GGAEMO C[N@H+]1CCC[C@H](CCNC(=O)N[C@@H]2CCc3cc(Br)ccc32)C1 ZINC000457940357 567506720 /nfs/dbraw/zinc/50/67/20/567506720.db2.gz IHEIHFFPVGOGTR-CXAGYDPISA-N 1 1 380.330 3.468 10 0 GGAEMO C[C@H](NC(=O)N1CC[NH2+]C[C@@](C)(F)C1)c1cc(F)c(Br)cc1F ZINC000529346825 567507195 /nfs/dbraw/zinc/50/71/95/567507195.db2.gz FOUQSASZFMMVFR-BJOHPYRUSA-N 1 1 394.235 3.131 10 0 GGAEMO O=C([C@@H]1CCC[N@@H+]1Cc1ccccn1)N1CCc2c1cccc2Br ZINC000643359871 567508254 /nfs/dbraw/zinc/50/82/54/567508254.db2.gz VSXNTLLMKJXHQA-SFHVURJKSA-N 1 1 386.293 3.398 10 0 GGAEMO O=C([C@@H]1CCC[N@H+]1Cc1ccccn1)N1CCc2c1cccc2Br ZINC000643359871 567508258 /nfs/dbraw/zinc/50/82/58/567508258.db2.gz VSXNTLLMKJXHQA-SFHVURJKSA-N 1 1 386.293 3.398 10 0 GGAEMO C[C@H]1CN(C(=O)NCc2cc(F)cc(Br)c2)CC[N@H+](C2CC2)C1 ZINC000457958981 567508498 /nfs/dbraw/zinc/50/84/98/567508498.db2.gz NMEMMVHCUTYRGC-GFCCVEGCSA-N 1 1 384.293 3.214 10 0 GGAEMO C[NH+](C)[C@@H](CNC(=O)N1CCO[C@](C)(C(F)F)C1)c1ccccc1Cl ZINC000663455333 567510976 /nfs/dbraw/zinc/51/09/76/567510976.db2.gz IXJNWLPZFHSBNJ-YOEHRIQHSA-N 1 1 375.847 3.008 10 0 GGAEMO C[NH2+]C[C@H]1CCCN(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)C1 ZINC000529380766 567511059 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COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2ncc(-c3ccc(Br)cc3)o2)C1 ZINC000595848835 567586866 /nfs/dbraw/zinc/58/68/66/567586866.db2.gz RWQQKNRALKFVPL-XBXGTLAGSA-N 1 1 379.254 3.488 10 0 GGAEMO C[C@H](NC(=O)NCC(C)(C)[N@H+]1CCC[C@@H](C)C1)c1ncc(Br)cn1 ZINC000644882126 567588114 /nfs/dbraw/zinc/58/81/14/567588114.db2.gz VAGBEDDFAUIKDV-OLZOCXBDSA-N 1 1 398.349 3.110 10 0 GGAEMO Cc1[nH]c(=O)c(Br)cc1C(=O)NCC[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000552461434 567590985 /nfs/dbraw/zinc/59/09/85/567590985.db2.gz QJICFAGIGOZFQZ-UHFFFAOYSA-N 1 1 396.329 3.266 10 0 GGAEMO COC(=O)c1sc2c(c1Br)CN(CCCn1cc[nH+]c1C)C2 ZINC000595906134 567591080 /nfs/dbraw/zinc/59/10/80/567591080.db2.gz XTHAYXPOMZTLRS-UHFFFAOYSA-N 1 1 384.299 3.208 10 0 GGAEMO COC(=O)c1sc2c(c1Br)CN(CC[C@@H]1CCCC[N@H+]1C)C2 ZINC000595910645 567591533 /nfs/dbraw/zinc/59/15/33/567591533.db2.gz WRPBXTBNOCGNOT-NSHDSACASA-N 1 1 387.343 3.487 10 0 GGAEMO CC(C)CCCNC(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595926402 567592716 /nfs/dbraw/zinc/59/27/16/567592716.db2.gz DOPPGBPWMXMHPY-UHFFFAOYSA-N 1 1 378.279 3.122 10 0 GGAEMO COC(=O)c1cccc(NC(=O)c2sc3c(c2Br)C[NH2+]C3)c1C ZINC000595925010 567593052 /nfs/dbraw/zinc/59/30/52/567593052.db2.gz QBLYCPKSNHNKQO-UHFFFAOYSA-N 1 1 395.278 3.461 10 0 GGAEMO CC(C)CCN(C)C(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595926442 567593176 /nfs/dbraw/zinc/59/31/76/567593176.db2.gz GGUCHNWKMYHUDQ-UHFFFAOYSA-N 1 1 378.279 3.074 10 0 GGAEMO CC[C@H](C)[C@H](C)NC(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595933366 567594464 /nfs/dbraw/zinc/59/44/64/567594464.db2.gz WQQLLYPQZIVVMJ-YUMQZZPRSA-N 1 1 378.279 3.120 10 0 GGAEMO C[C@@]1([NH3+])CCCC[C@@H]1C(=O)Nc1nc2ccc(I)cc2[nH]1 ZINC000595948872 567594508 /nfs/dbraw/zinc/59/45/08/567594508.db2.gz NPKINVBWNKSIFP-MEBBXXQBSA-N 1 1 398.248 3.014 10 0 GGAEMO CCCC1(CNC(=O)c2sc3c(c2I)C[NH2+]C3)CC1 ZINC000595940890 567594526 /nfs/dbraw/zinc/59/45/26/567594526.db2.gz JMIQGFGBLGGXEX-UHFFFAOYSA-N 1 1 390.290 3.266 10 0 GGAEMO C[C@H]1CCCCCN1C(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595935847 567594568 /nfs/dbraw/zinc/59/45/68/567594568.db2.gz WCQQATOOEJAJOX-VIFPVBQESA-N 1 1 390.290 3.361 10 0 GGAEMO CC[C@H](C)CN(C)C(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595937532 567594973 /nfs/dbraw/zinc/59/49/73/567594973.db2.gz WDIHHXFOOFWQFT-QMMMGPOBSA-N 1 1 378.279 3.074 10 0 GGAEMO C[C@H]1CCCN(C(=O)c2sc3c(c2I)C[NH2+]C3)[C@H]1C ZINC000595932895 567594980 /nfs/dbraw/zinc/59/49/80/567594980.db2.gz REHILMFYSLIGGI-IUCAKERBSA-N 1 1 390.290 3.217 10 0 GGAEMO CCN(C(=O)N[C@@H](c1cncc(Br)c1)C1CC1)[C@@H]1CC[N@@H+](CC)C1 ZINC000664850176 567595045 /nfs/dbraw/zinc/59/50/45/567595045.db2.gz IJQGBCTZNRUKKS-IAGOWNOFSA-N 1 1 395.345 3.421 10 0 GGAEMO C[C@@H]1CCN(C(=O)c2sc3c(c2I)C[NH2+]C3)[C@H](C)C1 ZINC000595963458 567595821 /nfs/dbraw/zinc/59/58/21/567595821.db2.gz SJMYKFUQRRWWQL-RKDXNWHRSA-N 1 1 390.290 3.217 10 0 GGAEMO CC[C@@H](C)CCNC(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595959889 567595964 /nfs/dbraw/zinc/59/59/64/567595964.db2.gz IHXCDJDAULUOLW-MRVPVSSYSA-N 1 1 378.279 3.122 10 0 GGAEMO O=C(Cc1cscc1Br)Nc1cccc(C[N@@H+]2CC[C@H](O)C2)c1 ZINC000552550125 567596134 /nfs/dbraw/zinc/59/61/34/567596134.db2.gz LHRMCAWYUCNGGT-HNNXBMFYSA-N 1 1 395.322 3.258 10 0 GGAEMO CC[C@@H]1CCC[C@@H]1NC(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595954985 567596396 /nfs/dbraw/zinc/59/63/96/567596396.db2.gz HIKBMFOBJOUWMW-SCZZXKLOSA-N 1 1 390.290 3.264 10 0 GGAEMO C[C@H]1CCCCN(C(=O)c2sc3c(c2I)C[NH2+]C3)C1 ZINC000595956367 567596453 /nfs/dbraw/zinc/59/64/53/567596453.db2.gz NQRLSJWKTMCXAP-VIFPVBQESA-N 1 1 390.290 3.218 10 0 GGAEMO CC[C@H](C)CCNC(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595959890 567596757 /nfs/dbraw/zinc/59/67/57/567596757.db2.gz IHXCDJDAULUOLW-QMMMGPOBSA-N 1 1 378.279 3.122 10 0 GGAEMO O=C(N[C@H]1CCc2c1ccc(F)c2Br)N1CC[NH+](C2CC2)CC1 ZINC000459061898 567597939 /nfs/dbraw/zinc/59/79/39/567597939.db2.gz LLSJKCGMEUZQSQ-HNNXBMFYSA-N 1 1 382.277 3.065 10 0 GGAEMO COCC[N@H+]1CCCN(C(=O)c2cc(Br)c3ccccc3c2)CC1 ZINC000644994851 567598420 /nfs/dbraw/zinc/59/84/20/567598420.db2.gz XXNZEZSDASICJF-UHFFFAOYSA-N 1 1 391.309 3.397 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)NCCc2cccc(Br)c2)[C@@H](C)C1 ZINC000459146831 567601135 /nfs/dbraw/zinc/60/11/35/567601135.db2.gz JFUWRBUAHLLQDH-WMLDXEAASA-N 1 1 382.346 3.363 10 0 GGAEMO O=C(N[C@H]1CCCc2sc(Cl)cc21)N1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC000664949996 567601405 /nfs/dbraw/zinc/60/14/05/567601405.db2.gz PKJWSJSRBVRQRD-HIFRSBDPSA-N 1 1 383.945 3.020 10 0 GGAEMO O=C(N[C@H]1CCCc2sc(Cl)cc21)N1CCC([N@H+]2CC[C@H](O)C2)CC1 ZINC000664949998 567601824 /nfs/dbraw/zinc/60/18/24/567601824.db2.gz PKJWSJSRBVRQRD-ZFWWWQNUSA-N 1 1 383.945 3.020 10 0 GGAEMO COc1nc(C)cc(C)c1CN(C)C(=O)[C@H]([NH3+])c1ccccc1Br ZINC000621678572 567604081 /nfs/dbraw/zinc/60/40/81/567604081.db2.gz XSIKHXBNZPBOII-MRXNPFEDSA-N 1 1 392.297 3.128 10 0 GGAEMO CCC[N@@H+](C)CC(=O)N1CCC[C@H]1c1ccccc1I ZINC000505991529 567606224 /nfs/dbraw/zinc/60/62/24/567606224.db2.gz JAPRKCFDORKNGS-HNNXBMFYSA-N 1 1 386.277 3.297 10 0 GGAEMO CCC[N@@H+](C)CC(=O)N1CCC[C@@H]1c1ccccc1I ZINC000505991530 567606520 /nfs/dbraw/zinc/60/65/20/567606520.db2.gz JAPRKCFDORKNGS-OAHLLOKOSA-N 1 1 386.277 3.297 10 0 GGAEMO COC(=O)[C@@](C)(O)C[NH2+][C@H](C)c1nc(-c2ccc(Br)cc2)cs1 ZINC000572022388 567607333 /nfs/dbraw/zinc/60/73/33/567607333.db2.gz ZAAZKWNIAKZPDM-HWPZZCPQSA-N 1 1 399.310 3.147 10 0 GGAEMO COCc1nc(CN2CC[NH+](CCOc3ccc(Cl)cc3)CC2)cs1 ZINC000506099365 567609281 /nfs/dbraw/zinc/60/92/81/567609281.db2.gz PKDQHLZFSCJWCZ-UHFFFAOYSA-N 1 1 381.929 3.140 10 0 GGAEMO C[C@H](CCN1CC[NH+](C)CC1)N[C@H](c1ccc(Br)cc1)C(F)F ZINC000621760695 567609981 /nfs/dbraw/zinc/60/99/81/567609981.db2.gz PYLSASPSTASJQZ-CZUORRHYSA-N 1 1 390.316 3.371 10 0 GGAEMO C[C@H](CCN1CC[NH+](C)CC1)N[C@@H](c1ccc(Br)cc1)C(F)F ZINC000621760694 567610638 /nfs/dbraw/zinc/61/06/38/567610638.db2.gz PYLSASPSTASJQZ-CJNGLKHVSA-N 1 1 390.316 3.371 10 0 GGAEMO COC(=O)[C@H]1CC12CC[NH+](Cc1nc3ccc(Br)cc3[nH]1)CC2 ZINC000480561895 567612318 /nfs/dbraw/zinc/61/23/18/567612318.db2.gz ZJQMKRRGKAGLNH-GFCCVEGCSA-N 1 1 378.270 3.101 10 0 GGAEMO CC[NH+](CC)CCO[C@@H]1CCN(Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000480559726 567612685 /nfs/dbraw/zinc/61/26/85/567612685.db2.gz VXQDINWPYUSQNG-OAHLLOKOSA-N 1 1 395.345 3.258 10 0 GGAEMO Cc1ncsc1CCNC(=O)N[C@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000572111454 567613925 /nfs/dbraw/zinc/61/39/25/567613925.db2.gz CVSJYCLWEDQGFT-RDJZCZTQSA-N 1 1 378.929 3.392 10 0 GGAEMO Cc1ncsc1CCNC(=O)N[C@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000572111454 567613929 /nfs/dbraw/zinc/61/39/29/567613929.db2.gz CVSJYCLWEDQGFT-RDJZCZTQSA-N 1 1 378.929 3.392 10 0 GGAEMO CC(C)[C@@]1(CO)CCC[N@@H+](C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000645248238 567614011 /nfs/dbraw/zinc/61/40/11/567614011.db2.gz LVKDOVAUQIRLIR-KDOFPFPSSA-N 1 1 376.324 3.464 10 0 GGAEMO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]Cc1ccc(S(=O)(=O)N(C)C)s1 ZINC000552903403 567615934 /nfs/dbraw/zinc/61/59/34/567615934.db2.gz RDFBEYZLNPJXBC-GFCCVEGCSA-N 1 1 384.571 3.109 10 0 GGAEMO COCc1cc(Cl)cc(S(=O)(=O)N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c1 ZINC000572170528 567618617 /nfs/dbraw/zinc/61/86/17/567618617.db2.gz VQNZVYXSPGJRSI-SJORKVTESA-N 1 1 386.945 3.122 10 0 GGAEMO Cn1cncc1CC[N@H+]1CCC[C@@H]1c1ccc(I)cc1 ZINC000459363573 567618742 /nfs/dbraw/zinc/61/87/42/567618742.db2.gz RLZHFGVVWVZZIM-MRXNPFEDSA-N 1 1 381.261 3.404 10 0 GGAEMO Cn1cncc1CC[N@H+]1CCC[C@H]1c1ccccc1I ZINC000459384652 567620024 /nfs/dbraw/zinc/62/00/24/567620024.db2.gz XZFYEFASXLUJOK-INIZCTEOSA-N 1 1 381.261 3.404 10 0 GGAEMO COC(=O)[C@H]1CCC[N@@H+](Cc2cn(-c3ccc(Br)cc3)nc2C)C1 ZINC000506293716 567620803 /nfs/dbraw/zinc/62/08/03/567620803.db2.gz FWMGHXLVODUTNC-AWEZNQCLSA-N 1 1 392.297 3.328 10 0 GGAEMO Cc1c(Br)cncc1C(=O)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000665347429 567621199 /nfs/dbraw/zinc/62/11/99/567621199.db2.gz KPKILOATZWRREH-OAHLLOKOSA-N 1 1 378.270 3.312 10 0 GGAEMO O=C(NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1)[C@@H]1[C@@H]2CCCO[C@H]12 ZINC000506333718 567622687 /nfs/dbraw/zinc/62/26/87/567622687.db2.gz YUULSPQNRGDCJV-QGTPRVQTSA-N 1 1 383.319 3.499 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CNC(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000665529478 567628195 /nfs/dbraw/zinc/62/81/95/567628195.db2.gz LNOHKABUFRTUPM-ZETCQYMHSA-N 1 1 383.183 3.220 10 0 GGAEMO C[N@@H+]1Cc2ccc(NC(=O)C(=O)NCc3ccc(Cl)cc3Cl)cc2C1 ZINC000506511578 567628324 /nfs/dbraw/zinc/62/83/24/567628324.db2.gz PGGWWGOLFISSIP-UHFFFAOYSA-N 1 1 378.259 3.194 10 0 GGAEMO C[N@H+]1Cc2ccc(NC(=O)C(=O)NCc3ccc(Cl)cc3Cl)cc2C1 ZINC000506511578 567628334 /nfs/dbraw/zinc/62/83/34/567628334.db2.gz PGGWWGOLFISSIP-UHFFFAOYSA-N 1 1 378.259 3.194 10 0 GGAEMO C[C@H]1C[N@H+](CCCOc2cccc(Cl)c2)CCN1C(=O)c1cscn1 ZINC000459500879 567631016 /nfs/dbraw/zinc/63/10/16/567631016.db2.gz BAVMINLLKLZFSL-AWEZNQCLSA-N 1 1 379.913 3.412 10 0 GGAEMO C[C@H]1C[N@@H+](CCCOc2cccc(Cl)c2)CCN1C(=O)c1cscn1 ZINC000459500879 567631021 /nfs/dbraw/zinc/63/10/21/567631021.db2.gz BAVMINLLKLZFSL-AWEZNQCLSA-N 1 1 379.913 3.412 10 0 GGAEMO CCOc1cc(C[N@@H+](C)CCCNC(=O)C2CCC2)cc(Br)c1O ZINC000459506651 567631317 /nfs/dbraw/zinc/63/13/17/567631317.db2.gz LFAIVYZLRJAOPK-UHFFFAOYSA-N 1 1 399.329 3.292 10 0 GGAEMO Cn1cncc1CC[N@@H+](CCc1ccc(Cl)cc1)C[C@@H](O)C(F)(F)F ZINC000459521073 567631973 /nfs/dbraw/zinc/63/19/73/567631973.db2.gz HCRGRSWBBMBJLO-MRXNPFEDSA-N 1 1 375.822 3.084 10 0 GGAEMO Cc1cc(C(=O)NCC[N@@H+]2CC[C@@H](C)C2)nn1-c1ccc(Br)cc1 ZINC000530949589 567632748 /nfs/dbraw/zinc/63/27/48/567632748.db2.gz YXIYXSYMNUSNID-CYBMUJFWSA-N 1 1 391.313 3.015 10 0 GGAEMO CC(C)OC[C@@H](O)C[N@H+]1CCC[C@H]1c1ccccc1I ZINC000506597379 567632857 /nfs/dbraw/zinc/63/28/57/567632857.db2.gz VJABKZMFHKHQMT-BBRMVZONSA-N 1 1 389.277 3.214 10 0 GGAEMO CCOc1cc(C[N@H+]2CCC[C@@H](OCCOC)C2)cc(Br)c1O ZINC000459537559 567634413 /nfs/dbraw/zinc/63/44/13/567634413.db2.gz IOGNDQUZHKITMC-CQSZACIVSA-N 1 1 388.302 3.181 10 0 GGAEMO C[C@@H]1C[N@@H+](CC(C)(C)O)CCN1c1ccc(Br)c(C(F)(F)F)n1 ZINC000553211697 567635065 /nfs/dbraw/zinc/63/50/65/567635065.db2.gz CIYGNHICOVNZLO-SNVBAGLBSA-N 1 1 396.251 3.144 10 0 GGAEMO C[N@H+]1CCC[C@@H](N2CCN(c3nccc4cc(Br)ccc43)CC2)C1 ZINC000665701481 567636106 /nfs/dbraw/zinc/63/61/06/567636106.db2.gz VBCQNFMNEDNQCS-QGZVFWFLSA-N 1 1 389.341 3.214 10 0 GGAEMO CCC[C@@H]1CN(Cc2nc3cc(Br)ccc3[nH]2)CC[N@H+]1CCOC ZINC000480856292 567636378 /nfs/dbraw/zinc/63/63/78/567636378.db2.gz JYLOFFOUQSMSKS-OAHLLOKOSA-N 1 1 395.345 3.258 10 0 GGAEMO CCC[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CC[N@@H+]1CCOC ZINC000480856292 567636382 /nfs/dbraw/zinc/63/63/82/567636382.db2.gz JYLOFFOUQSMSKS-OAHLLOKOSA-N 1 1 395.345 3.258 10 0 GGAEMO CCC[C@@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CC[N@H+]1CCOC ZINC000480856292 567636387 /nfs/dbraw/zinc/63/63/87/567636387.db2.gz JYLOFFOUQSMSKS-OAHLLOKOSA-N 1 1 395.345 3.258 10 0 GGAEMO CCOc1cc(C[N@@H+](CCO)C2CCSCC2)cc(Br)c1O ZINC000459567507 567638153 /nfs/dbraw/zinc/63/81/53/567638153.db2.gz IOVFHSXWADWKRQ-UHFFFAOYSA-N 1 1 390.343 3.243 10 0 GGAEMO CN([C@@H]1CC[N@@H+](C2CC2)C1)S(=O)(=O)c1cc(Cl)ccc1OC(F)(F)F ZINC000645529480 567638565 /nfs/dbraw/zinc/63/85/65/567638565.db2.gz HWWRSQAEIRSLBZ-GFCCVEGCSA-N 1 1 398.834 3.096 10 0 GGAEMO CN([C@@H]1CC[N@H+](C2CC2)C1)S(=O)(=O)c1cc(Cl)ccc1OC(F)(F)F ZINC000645529480 567638570 /nfs/dbraw/zinc/63/85/70/567638570.db2.gz HWWRSQAEIRSLBZ-GFCCVEGCSA-N 1 1 398.834 3.096 10 0 GGAEMO CCOc1cc(C[N@@H+]2CC[C@@H]([C@H](O)C(F)(F)F)C2)cc(Br)c1O ZINC000459579555 567640022 /nfs/dbraw/zinc/64/00/22/567640022.db2.gz ZBONUSJQBMEKQF-YGRLFVJLSA-N 1 1 398.219 3.299 10 0 GGAEMO CCOc1cc(C[N@H+]2CC[C@@H]([C@H](O)C(F)(F)F)C2)cc(Br)c1O ZINC000459579555 567640028 /nfs/dbraw/zinc/64/00/28/567640028.db2.gz ZBONUSJQBMEKQF-YGRLFVJLSA-N 1 1 398.219 3.299 10 0 GGAEMO CCOc1cc(CN2CC[C@]3(C2)CCC[N@@H+](C)C3)cc(Br)c1O ZINC000459597110 567640793 /nfs/dbraw/zinc/64/07/93/567640793.db2.gz VAYOFWJNNAWEHW-GOSISDBHSA-N 1 1 383.330 3.471 10 0 GGAEMO CCN1CC[C@H]([N@H+](C)CCC(=O)Nc2ccc(Br)cc2)[C@@H](C)C1 ZINC000440701207 567641386 /nfs/dbraw/zinc/64/13/86/567641386.db2.gz IKVKTLNUSODBHI-YOEHRIQHSA-N 1 1 382.346 3.440 10 0 GGAEMO CCN1CC[C@H]([N@@H+](C)CCC(=O)Nc2ccc(Br)cc2)[C@@H](C)C1 ZINC000440701207 567641388 /nfs/dbraw/zinc/64/13/88/567641388.db2.gz IKVKTLNUSODBHI-YOEHRIQHSA-N 1 1 382.346 3.440 10 0 GGAEMO CCNC(=O)C1C[NH+](Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000459614459 567642630 /nfs/dbraw/zinc/64/26/30/567642630.db2.gz WXKQKGYSFQLGMV-UHFFFAOYSA-N 1 1 380.311 3.141 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)Nc1ccccc1I ZINC000596626527 567643745 /nfs/dbraw/zinc/64/37/45/567643745.db2.gz JIILTBQQAIVFSP-NSHDSACASA-N 1 1 387.265 3.286 10 0 GGAEMO C[NH+](C)[C@@H](CNS(=O)(=O)N1CCC2(CCCCC2)CC1)c1ccsc1 ZINC000480935246 567643826 /nfs/dbraw/zinc/64/38/26/567643826.db2.gz LKHWQFQLRJTECW-KRWDZBQOSA-N 1 1 385.599 3.232 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)Nc1ccccc1I ZINC000596626525 567644105 /nfs/dbraw/zinc/64/41/05/567644105.db2.gz JIILTBQQAIVFSP-LLVKDONJSA-N 1 1 387.265 3.286 10 0 GGAEMO C[NH+](C)[C@H](CNS(=O)(=O)N1CCC2(CCCCC2)CC1)c1ccsc1 ZINC000480935248 567644340 /nfs/dbraw/zinc/64/43/40/567644340.db2.gz LKHWQFQLRJTECW-QGZVFWFLSA-N 1 1 385.599 3.232 10 0 GGAEMO 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CCOCC[C@H](O)C[N@H+]1CCC[C@H]1c1ccc(I)cc1 ZINC000444647854 567810967 /nfs/dbraw/zinc/81/09/67/567810967.db2.gz GAFYVQGBTFMUBG-HOTGVXAUSA-N 1 1 389.277 3.216 10 0 GGAEMO OCCCOC1CC[NH+](Cc2cc(OC(F)F)ccc2Br)CC1 ZINC000648010474 567811000 /nfs/dbraw/zinc/81/10/00/567811000.db2.gz DRTJJSMPYIAXOA-UHFFFAOYSA-N 1 1 394.256 3.414 10 0 GGAEMO Cc1cc(C(=O)N2CC[NH2+]C[C@@](C)(F)C2)nn1-c1ccc(Cl)cc1Cl ZINC000575058714 567811336 /nfs/dbraw/zinc/81/13/36/567811336.db2.gz QPDSLDUNRZMFAW-QGZVFWFLSA-N 1 1 385.270 3.261 10 0 GGAEMO C[N@H+](CCC(F)(F)F)[C@@H](CNC(=O)C(C)(C)CO)c1ccc(Cl)cc1 ZINC000575071478 567811506 /nfs/dbraw/zinc/81/15/06/567811506.db2.gz ZPOMIFBZGWOEMR-AWEZNQCLSA-N 1 1 380.838 3.400 10 0 GGAEMO C[N@@H+](CCC(F)(F)F)[C@@H](CNC(=O)C(C)(C)CO)c1ccc(Cl)cc1 ZINC000575071478 567811508 /nfs/dbraw/zinc/81/15/08/567811508.db2.gz ZPOMIFBZGWOEMR-AWEZNQCLSA-N 1 1 380.838 3.400 10 0 GGAEMO COc1cc(Br)ccc1CN1CC[NH+](Cc2cccc(O)c2)CC1 ZINC000575084994 567812394 /nfs/dbraw/zinc/81/23/94/567812394.db2.gz XOJVOJPTSWBLPE-UHFFFAOYSA-N 1 1 391.309 3.481 10 0 GGAEMO COCc1ncc(C(=O)Nc2ccc(C[NH+](C)C)c(Br)c2)s1 ZINC000575079188 567812397 /nfs/dbraw/zinc/81/23/97/567812397.db2.gz QYXCAMNYWSJPLI-UHFFFAOYSA-N 1 1 384.299 3.366 10 0 GGAEMO Cn1ncc(Br)c1C[NH2+][C@@H](c1ccccc1)C1(CO)CC=CC1 ZINC000648068940 567812578 /nfs/dbraw/zinc/81/25/78/567812578.db2.gz IZPZKGRBHDYKTI-KRWDZBQOSA-N 1 1 376.298 3.342 10 0 GGAEMO COc1cc(C[N@@H+](C)CC2CN(C)C2)cc(Br)c1OC(F)F ZINC000668538411 567812983 /nfs/dbraw/zinc/81/29/83/567812983.db2.gz ZXJUQTROYCYIDB-UHFFFAOYSA-N 1 1 379.245 3.053 10 0 GGAEMO COc1cc(CN(C)CC2C[NH+](C)C2)cc(Br)c1OC(F)F ZINC000668538411 567812984 /nfs/dbraw/zinc/81/29/84/567812984.db2.gz ZXJUQTROYCYIDB-UHFFFAOYSA-N 1 1 379.245 3.053 10 0 GGAEMO COc1c(Br)cc(Br)cc1C[N@H+](C)CC1CN(C)C1 ZINC000668538187 567813378 /nfs/dbraw/zinc/81/33/78/567813378.db2.gz VZIPSEDVONVSIO-UHFFFAOYSA-N 1 1 392.135 3.214 10 0 GGAEMO COc1c(Br)cc(Br)cc1C[N@@H+](C)CC1CN(C)C1 ZINC000668538187 567813380 /nfs/dbraw/zinc/81/33/80/567813380.db2.gz VZIPSEDVONVSIO-UHFFFAOYSA-N 1 1 392.135 3.214 10 0 GGAEMO CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2sc(C)cc2Br)C1 ZINC000648072967 567813453 /nfs/dbraw/zinc/81/34/53/567813453.db2.gz YBHAZGDKNZKPCI-LBPRGKRZSA-N 1 1 385.249 3.319 10 0 GGAEMO O[C@@]1(C2CC2)CCC[N@@H+](Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000668557737 567813620 /nfs/dbraw/zinc/81/36/20/567813620.db2.gz MNYPTSVTOBVTNQ-IBGZPJMESA-N 1 1 395.341 3.023 10 0 GGAEMO Cc1c(Br)cncc1C(=O)NC[C@@H](C)[N@@H+](C)Cc1ccccc1 ZINC000668567898 567813854 /nfs/dbraw/zinc/81/38/54/567813854.db2.gz NKRRUUPUOVVCCG-CYBMUJFWSA-N 1 1 376.298 3.403 10 0 GGAEMO O[C@]1(C2CC2)CCC[N@@H+](Cc2ccc(Br)cc2N2CCOCC2)C1 ZINC000668557738 567813951 /nfs/dbraw/zinc/81/39/51/567813951.db2.gz MNYPTSVTOBVTNQ-LJQANCHMSA-N 1 1 395.341 3.023 10 0 GGAEMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1ccc(Cl)c(N)c1Cl ZINC000648130298 567814080 /nfs/dbraw/zinc/81/40/80/567814080.db2.gz XKCPCZFGOFHZKO-AWEZNQCLSA-N 1 1 380.275 3.371 10 0 GGAEMO Cc1nn(-c2ccccc2Br)cc1C[N@H+]1C[C@@H]2COC[C@@]2(C)C1 ZINC000668597161 567814057 /nfs/dbraw/zinc/81/40/57/567814057.db2.gz RNQJCJHAFZCKHG-CRAIPNDOSA-N 1 1 376.298 3.412 10 0 GGAEMO Cc1nn(-c2cccc(Br)c2)cc1C[N@H+]1C[C@H]2COC[C@]2(C)C1 ZINC000668596270 567814064 /nfs/dbraw/zinc/81/40/64/567814064.db2.gz FMJMYYAEQKVNQW-YJBOKZPZSA-N 1 1 376.298 3.412 10 0 GGAEMO CN(C(=O)c1c(F)c(F)c(Br)c(F)c1F)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000668599384 567814589 /nfs/dbraw/zinc/81/45/89/567814589.db2.gz WEFGYVJIXXYXIT-MRVPVSSYSA-N 1 1 395.194 3.314 10 0 GGAEMO C[C@@]12COC[C@H]1C[N@H+](Cc1cc(Br)cc(Br)c1N)C2 ZINC000668598278 567814823 /nfs/dbraw/zinc/81/48/23/567814823.db2.gz XRRAQUSITKLZHZ-QMTHXVAHSA-N 1 1 390.119 3.262 10 0 GGAEMO C[C@@]12COC[C@H]1C[N@@H+](Cc1cc(Br)cc(Br)c1N)C2 ZINC000668598278 567814824 /nfs/dbraw/zinc/81/48/24/567814824.db2.gz XRRAQUSITKLZHZ-QMTHXVAHSA-N 1 1 390.119 3.262 10 0 GGAEMO Cc1nn(-c2ccc(Br)cc2)cc1C[N@H+]1C[C@H]2COC[C@@]2(C)C1 ZINC000668598575 567814829 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GGAEMO Cc1ccc(N2CCC[N@H+](CN3C(=O)NC4(CCCCCCC4)C3=O)CC2)cc1 ZINC000048340511 570239224 /nfs/dbraw/zinc/23/92/24/570239224.db2.gz RJPXERNDDPCOSH-UHFFFAOYSA-N 1 1 398.551 3.500 10 0 GGAEMO Cc1ccc(N2CCC[N@@H+](CN3C(=O)NC4(CCCCCCC4)C3=O)CC2)cc1 ZINC000048340511 570239226 /nfs/dbraw/zinc/23/92/26/570239226.db2.gz RJPXERNDDPCOSH-UHFFFAOYSA-N 1 1 398.551 3.500 10 0 GGAEMO COc1ccc([C@@H]2CCCCC[N@@H+]2CN2C(=O)C(=O)N(C3CCCC3)C2=O)cc1 ZINC000049590284 570271617 /nfs/dbraw/zinc/27/16/17/570271617.db2.gz LUAMTPLDDYJCLN-IBGZPJMESA-N 1 1 399.491 3.303 10 0 GGAEMO COc1ccc([C@@H]2CCCCC[N@H+]2CN2C(=O)C(=O)N(C3CCCC3)C2=O)cc1 ZINC000049590284 570271619 /nfs/dbraw/zinc/27/16/19/570271619.db2.gz LUAMTPLDDYJCLN-IBGZPJMESA-N 1 1 399.491 3.303 10 0 GGAEMO COc1ccccc1N1CC[NH+](Cc2ccc(C(=O)NCC(C)C)cc2)CC1 ZINC000034668495 570292948 /nfs/dbraw/zinc/29/29/48/570292948.db2.gz DMYKEFZVHJNOFR-UHFFFAOYSA-N 1 1 381.520 3.403 10 0 GGAEMO O[C@@H](Cc1ccccc1)C[N@@H+]1CCO[C@H](COc2cccc(C(F)(F)F)c2)C1 ZINC000034671001 570293340 /nfs/dbraw/zinc/29/33/40/570293340.db2.gz OMUPLIUWOCSMJT-ICSRJNTNSA-N 1 1 395.421 3.389 10 0 GGAEMO O[C@@H](Cc1ccccc1)C[N@H+]1CCO[C@H](COc2cccc(C(F)(F)F)c2)C1 ZINC000034671001 570293342 /nfs/dbraw/zinc/29/33/42/570293342.db2.gz OMUPLIUWOCSMJT-ICSRJNTNSA-N 1 1 395.421 3.389 10 0 GGAEMO O[C@H](Cc1ccccc1)C[N@@H+]1CCO[C@H](COc2cccc(C(F)(F)F)c2)C1 ZINC000034671003 570293379 /nfs/dbraw/zinc/29/33/79/570293379.db2.gz OMUPLIUWOCSMJT-QUCCMNQESA-N 1 1 395.421 3.389 10 0 GGAEMO O[C@H](Cc1ccccc1)C[N@H+]1CCO[C@H](COc2cccc(C(F)(F)F)c2)C1 ZINC000034671003 570293382 /nfs/dbraw/zinc/29/33/82/570293382.db2.gz OMUPLIUWOCSMJT-QUCCMNQESA-N 1 1 395.421 3.389 10 0 GGAEMO CCC(=O)N(Cc1ccc(F)cc1)c1ccc(CC(=O)N2CC[NH+](C)CC2)cc1 ZINC000034675507 570293710 /nfs/dbraw/zinc/29/37/10/570293710.db2.gz LECLWIIZGSVSKH-UHFFFAOYSA-N 1 1 397.494 3.085 10 0 GGAEMO Cc1cccc(N2CC[C@@H](C(=O)N3CC[NH+](Cc4ccccc4)CC3)C2=O)c1C ZINC000034676079 570293825 /nfs/dbraw/zinc/29/38/25/570293825.db2.gz SQCBTWRBVAVZHW-NRFANRHFSA-N 1 1 391.515 3.001 10 0 GGAEMO Cc1cc(NC(=O)C[N@H+](C)CCOc2ccccc2F)n(-c2ccccc2)n1 ZINC000012922323 570295065 /nfs/dbraw/zinc/29/50/65/570295065.db2.gz TYCMFWVHEPIMBF-UHFFFAOYSA-N 1 1 382.439 3.269 10 0 GGAEMO Cc1cc(NC(=O)C[N@@H+](C)CCOc2ccccc2F)n(-c2ccccc2)n1 ZINC000012922323 570295067 /nfs/dbraw/zinc/29/50/67/570295067.db2.gz TYCMFWVHEPIMBF-UHFFFAOYSA-N 1 1 382.439 3.269 10 0 GGAEMO Cc1ccc(C[N@@H+](C)CC(=O)N(C)CC(=O)Nc2cc(C)ccc2C)c(C)c1 ZINC000012927107 570297329 /nfs/dbraw/zinc/29/73/29/570297329.db2.gz JRECELYKLCQUIS-UHFFFAOYSA-N 1 1 381.520 3.449 10 0 GGAEMO Cc1ccc(C[N@H+](C)CC(=O)N(C)CC(=O)Nc2cc(C)ccc2C)c(C)c1 ZINC000012927107 570297333 /nfs/dbraw/zinc/29/73/33/570297333.db2.gz JRECELYKLCQUIS-UHFFFAOYSA-N 1 1 381.520 3.449 10 0 GGAEMO C[C@@H](Cc1ccc2c(c1)OCO2)C[N@H+]1CCc2nc(-c3cccnc3)[nH]c2C1 ZINC000216368238 570300079 /nfs/dbraw/zinc/30/00/79/570300079.db2.gz MOIXHQRHEVNGOU-HNNXBMFYSA-N 1 1 376.460 3.437 10 0 GGAEMO 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CC[N@H+]1CCC[C@H]1CNC(=O)c1nc(Cc2ccccc2)n(-c2ccccc2)n1 ZINC000034911121 570340676 /nfs/dbraw/zinc/34/06/76/570340676.db2.gz JPXHTLOSXRUNIS-FQEVSTJZSA-N 1 1 389.503 3.072 10 0 GGAEMO CC[C@@H](C(=O)NCc1ccccc1)[N@H+]1CCC[C@@H](C(=O)Nc2ccccc2)C1 ZINC000024835895 570342012 /nfs/dbraw/zinc/34/20/12/570342012.db2.gz ILSLJICGBDOEPC-CTNGQTDRSA-N 1 1 379.504 3.432 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)CC1CCN(C(=O)NC2CCCCC2)CC1 ZINC000035399192 570349657 /nfs/dbraw/zinc/34/96/57/570349657.db2.gz GTYBCVJGMFACDP-GOSISDBHSA-N 1 1 392.588 3.121 10 0 GGAEMO C[C@@H]1CN(Cc2ccccc2C[NH2+]Cc2c[nH]nc2-c2cccnc2)C[C@@H](C)O1 ZINC000237572822 570381258 /nfs/dbraw/zinc/38/12/58/570381258.db2.gz UUMRINVWULRCQU-QZTJIDSGSA-N 1 1 391.519 3.371 10 0 GGAEMO Cc1nn(C)c2ncc(C[NH2+]Cc3ccccc3CN3C[C@H](C)O[C@@H](C)C3)cc12 ZINC000237779034 570396004 /nfs/dbraw/zinc/39/60/04/570396004.db2.gz IVONGRWHXSYKIS-IRXDYDNUSA-N 1 1 393.535 3.176 10 0 GGAEMO Cc1cc2nc(C)c(=O)n(CC(=O)NCCC[N@H+](C)C3CCCCC3)c2cc1C ZINC000032974672 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377.481 3.475 10 0 GGAEMO CCC[N@H+](Cc1ccc(OC)c(OC)c1)C[C@H](O)COc1ccc(OC)cc1 ZINC000036095966 570535609 /nfs/dbraw/zinc/53/56/09/570535609.db2.gz LEWOVYLBLQSUKA-SFHVURJKSA-N 1 1 389.492 3.364 10 0 GGAEMO CC[C@H](C)[N@H+](Cc1ccc(OC)c(OC)c1)C[C@H](O)COCc1ccco1 ZINC000036095814 570535621 /nfs/dbraw/zinc/53/56/21/570535621.db2.gz LLCBFTLQGJPFNA-WMZOPIPTSA-N 1 1 377.481 3.475 10 0 GGAEMO COc1cccc(C[N@H+](Cc2ccc3c(c2)OCO3)C[C@H](O)COC(C)C)c1 ZINC000036098461 570536670 /nfs/dbraw/zinc/53/66/70/570536670.db2.gz ZVUFYJQAPWDBAM-IBGZPJMESA-N 1 1 387.476 3.212 10 0 GGAEMO COc1ccc(OC[C@@H](O)C[N@H+](Cc2ccccc2C)C[C@H]2CCCO2)cc1 ZINC000036100017 570537962 /nfs/dbraw/zinc/53/79/62/570537962.db2.gz JMPCQSYIWZWKNS-NZQKXSOJSA-N 1 1 385.504 3.425 10 0 GGAEMO CCCC(=O)OC[C@@H](O)C[N@@H+](Cc1ccccc1)Cc1ccc2c(c1)OCO2 ZINC000036103577 570539935 /nfs/dbraw/zinc/53/99/35/570539935.db2.gz NSFZPTZSGGLOEN-IBGZPJMESA-N 1 1 385.460 3.122 10 0 GGAEMO COc1cccc(C[N@@H+](Cc2ccco2)C[C@H](O)COC(C)(C)C)c1OC ZINC000036103613 570540362 /nfs/dbraw/zinc/54/03/62/570540362.db2.gz JOJNCBWUYWXKGA-KRWDZBQOSA-N 1 1 377.481 3.475 10 0 GGAEMO COc1cccc(C[N@H+](Cc2ccco2)C[C@H](O)COC(C)(C)C)c1OC ZINC000036103613 570540365 /nfs/dbraw/zinc/54/03/65/570540365.db2.gz JOJNCBWUYWXKGA-KRWDZBQOSA-N 1 1 377.481 3.475 10 0 GGAEMO COc1cc(CNC(=O)C2=CC[N@@H+](Cc3cccc(C)c3)CC2)cc(OC)c1 ZINC000064818037 570553352 /nfs/dbraw/zinc/55/33/52/570553352.db2.gz IRFJRRNKCPEXQZ-UHFFFAOYSA-N 1 1 380.488 3.461 10 0 GGAEMO COc1ccc(CNC(=O)C2=CC[N@@H+](Cc3ccc(F)cc3)CC2)cc1OC ZINC000064818055 570553677 /nfs/dbraw/zinc/55/36/77/570553677.db2.gz ULLOBDKFGPBGAB-UHFFFAOYSA-N 1 1 384.451 3.291 10 0 GGAEMO COc1ccc(OC)c(CNC(=O)C2=CC[N@@H+](Cc3cccc(F)c3)CC2)c1 ZINC000064818097 570553719 /nfs/dbraw/zinc/55/37/19/570553719.db2.gz PDQJYOKHXYIAGF-UHFFFAOYSA-N 1 1 384.451 3.291 10 0 GGAEMO COc1ccc(OC[C@H](O)C[N@@H+](Cc2ccc(OC)c(OC)c2)C2CC2)cc1 ZINC000036095841 570560676 /nfs/dbraw/zinc/56/06/76/570560676.db2.gz RMFSWBMNTHIEPQ-GOSISDBHSA-N 1 1 387.476 3.117 10 0 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570580721 /nfs/dbraw/zinc/58/07/21/570580721.db2.gz GBPCDLIELTWAMC-ICSRJNTNSA-N 1 1 392.588 3.074 10 0 GGAEMO C[C@H]1CCCCN1C(=O)[C@@H](C1CCCC1)[NH+]1CCN(C(=O)c2ccccc2)CC1 ZINC000036250226 570585442 /nfs/dbraw/zinc/58/54/42/570585442.db2.gz QEDKXPOOJYDUEX-SIKLNZKXSA-N 1 1 397.563 3.404 10 0 GGAEMO CC[C@@H](C)NC(=O)[C@@H](C1CCCC1)[NH+]1CCN(C(=O)CCc2ccccc2)CC1 ZINC000036251981 570586285 /nfs/dbraw/zinc/58/62/85/570586285.db2.gz BBRBRYMIWNFDNH-AUSIDOKSSA-N 1 1 399.579 3.237 10 0 GGAEMO CCc1ccc(C(=O)N2CC[NH+]([C@H](C(=O)N(C)CC)C3CCCC3)CC2)cc1 ZINC000036251096 570587416 /nfs/dbraw/zinc/58/74/16/570587416.db2.gz DWZJFUVKOMIJFI-NRFANRHFSA-N 1 1 385.552 3.044 10 0 GGAEMO CCOc1ccc(C[N@@H+](C)C[C@H](O)COCc2ccc(OC)cc2)cc1OC ZINC000006787513 570593025 /nfs/dbraw/zinc/59/30/25/570593025.db2.gz DUAQFJCCMHHOJY-IBGZPJMESA-N 1 1 389.492 3.112 10 0 GGAEMO CC(=O)Nc1ccc(C2=NN(C(=O)C[NH+]3CCCC3)[C@H](c3ccco3)C2)cc1 ZINC000225635049 570596498 /nfs/dbraw/zinc/59/64/98/570596498.db2.gz SCGVWLJGHDKATK-IBGZPJMESA-N 1 1 380.448 3.012 10 0 GGAEMO COc1cccc(C[N@@H+](C[C@@H](O)COCc2ccccc2)C[C@@H]2CCCO2)c1 ZINC000169677850 570597596 /nfs/dbraw/zinc/59/75/96/570597596.db2.gz CCSFFZXXRJDHTL-GGAORHGYSA-N 1 1 385.504 3.254 10 0 GGAEMO COc1ccc(C[N@@H+](C[C@@H](O)COCc2ccccc2)C[C@@H]2CCCO2)cc1 ZINC000169678600 570598894 /nfs/dbraw/zinc/59/88/94/570598894.db2.gz DNBYZIGABNUDHN-GGAORHGYSA-N 1 1 385.504 3.254 10 0 GGAEMO CC[C@H](C)[N@H+](Cc1cc(OC)cc(OC)c1)C[C@@H](O)COCc1ccco1 ZINC000169679628 570600800 /nfs/dbraw/zinc/60/08/00/570600800.db2.gz FCSRENDJJCMILH-FUHWJXTLSA-N 1 1 377.481 3.475 10 0 GGAEMO CC(C)CNC(=O)[C@@H]1Cc2ccccc2N2CC[N@@H+](Cc3ccc(F)cc3)C[C@@H]12 ZINC000169681661 570602060 /nfs/dbraw/zinc/60/20/60/570602060.db2.gz ATJSGHZSKHAGRG-GGAORHGYSA-N 1 1 395.522 3.461 10 0 GGAEMO COc1ccc(C[N@H+]2CC[C@H]3[C@H](CCC(=O)N3Cc3cccnc3)C2)cc1C ZINC000012078402 570605642 /nfs/dbraw/zinc/60/56/42/570605642.db2.gz GQCYFZDSAFOPQA-RTWAWAEBSA-N 1 1 379.504 3.412 10 0 GGAEMO 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Cc1ccc(-c2noc([C@H](C)[N@@H+]3CCCN(c4cccnn4)CC3)n2)cc1F ZINC000106071600 1411164428 /nfs/dbraw/zinc/16/44/28/1411164428.db2.gz LIHAFWWCZQYEPD-HNNXBMFYSA-N 1 1 382.443 3.247 10 0 GGAEMO Cc1ccc(-c2noc([C@H](C)[N@H+]3CCCN(c4cccnn4)CC3)n2)cc1F ZINC000106071600 1411164439 /nfs/dbraw/zinc/16/44/39/1411164439.db2.gz LIHAFWWCZQYEPD-HNNXBMFYSA-N 1 1 382.443 3.247 10 0 GGAEMO CCOCC[NH+]1CCN([C@@H](C)C(=O)N[C@H](C)c2cccc3ccccc32)CC1 ZINC000106105484 1411168460 /nfs/dbraw/zinc/16/84/60/1411168460.db2.gz BLZNHHCBDSUDRF-MOPGFXCFSA-N 1 1 383.536 3.060 10 0 GGAEMO CCOCC[NH+]1CCN([C@@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)CC1 ZINC000106105481 1411168751 /nfs/dbraw/zinc/16/87/51/1411168751.db2.gz BLZNHHCBDSUDRF-OALUTQOASA-N 1 1 383.536 3.060 10 0 GGAEMO COc1ccc(C[NH2+][C@@H](C)c2nc(C(C)(C)C)cs2)cc1OCC(N)=O ZINC000106476137 1411223768 /nfs/dbraw/zinc/22/37/68/1411223768.db2.gz AKBIQAJVWAOBDS-LBPRGKRZSA-N 1 1 377.510 3.164 10 0 GGAEMO COc1ccc(C[NH2+][C@H](C)c2nc(C(C)(C)C)cs2)cc1OCC(N)=O ZINC000106476138 1411224429 /nfs/dbraw/zinc/22/44/29/1411224429.db2.gz AKBIQAJVWAOBDS-GFCCVEGCSA-N 1 1 377.510 3.164 10 0 GGAEMO COc1ccc(CN(C)C(=O)C[N@H+](C)[C@H](C)c2sc(C)nc2C)cc1OC ZINC000106936640 1411322605 /nfs/dbraw/zinc/32/26/05/1411322605.db2.gz CCOSYYRUXWWELJ-CQSZACIVSA-N 1 1 391.537 3.429 10 0 GGAEMO COc1ccc(CN(C)C(=O)C[N@@H+](C)[C@H](C)c2sc(C)nc2C)cc1OC ZINC000106936640 1411322609 /nfs/dbraw/zinc/32/26/09/1411322609.db2.gz CCOSYYRUXWWELJ-CQSZACIVSA-N 1 1 391.537 3.429 10 0 GGAEMO COc1ccc(C[NH2+]Cc2ccc(N3CCO[C@@H](C)C3)nc2)c(Cl)c1OC ZINC000107315246 1411360425 /nfs/dbraw/zinc/36/04/25/1411360425.db2.gz DKHWMXHISXEHRH-AWEZNQCLSA-N 1 1 391.899 3.267 10 0 GGAEMO CC[NH+]1CCN(CCCCNC(=O)[C@H]2C[C@@H]2c2cccc3ccccc32)CC1 ZINC000107780405 1411410338 /nfs/dbraw/zinc/41/03/38/1411410338.db2.gz FYXNDSNHYPRUNS-PKTZIBPZSA-N 1 1 379.548 3.477 10 0 GGAEMO CN(CC[N@@H+](C)C1CCN(C)CC1)C(=O)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000107781117 1411410770 /nfs/dbraw/zinc/41/07/70/1411410770.db2.gz HITXMYGIVBZYSA-PKTZIBPZSA-N 1 1 379.548 3.428 10 0 GGAEMO CN(CCN(C)C1CC[NH+](C)CC1)C(=O)[C@H]1C[C@@H]1c1cccc2ccccc21 ZINC000107781117 1411410782 /nfs/dbraw/zinc/41/07/82/1411410782.db2.gz HITXMYGIVBZYSA-PKTZIBPZSA-N 1 1 379.548 3.428 10 0 GGAEMO Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)[NH+]1CCC(n2ccnc2)CC1 ZINC000109795375 1411811167 /nfs/dbraw/zinc/81/11/67/1411811167.db2.gz GKRLYZZIUDSXKS-SFHVURJKSA-N 1 1 392.507 3.350 10 0 GGAEMO Cc1nn(C)c(OCC(F)(F)F)c1CNC[C@H](C)[N@@H+](C)Cc1ccccc1 ZINC000111389564 1411938910 /nfs/dbraw/zinc/93/89/10/1411938910.db2.gz CHNTVOJRHUYFNN-AWEZNQCLSA-N 1 1 384.446 3.280 10 0 GGAEMO Cc1nn(C)c(OCC(F)(F)F)c1C[NH2+]C[C@H](C)N(C)Cc1ccccc1 ZINC000111389564 1411938912 /nfs/dbraw/zinc/93/89/12/1411938912.db2.gz CHNTVOJRHUYFNN-AWEZNQCLSA-N 1 1 384.446 3.280 10 0 GGAEMO C[C@H](CNC(=O)NCc1cnn(Cc2ccccc2)c1)[N@@H+](C)Cc1ccccc1 ZINC000111470639 1411971834 /nfs/dbraw/zinc/97/18/34/1411971834.db2.gz BUQZJBXAOIDSEN-LJQANCHMSA-N 1 1 391.519 3.251 10 0 GGAEMO C[C@H](CNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1)[N@@H+](C)Cc1ccccc1 ZINC000112297553 1412126597 /nfs/dbraw/zinc/12/65/97/1412126597.db2.gz HXUZXMRCPAKTAO-NRSPTQNISA-N 1 1 385.552 3.052 10 0 GGAEMO CC(C)[C@H](CO)[N@@H+](CC(=O)Nc1ccnn1C1CCCC1)Cc1ccccc1 ZINC000112658013 1412187772 /nfs/dbraw/zinc/18/77/72/1412187772.db2.gz HZUFVJSIOKPXSY-FQEVSTJZSA-N 1 1 384.524 3.456 10 0 GGAEMO COc1ccc([C@H](CO)[N@@H+](C)C[C@@H](O)c2ccc(Br)cc2)cc1 ZINC000112995802 1412251851 /nfs/dbraw/zinc/25/18/51/1412251851.db2.gz HLOCHYDSGNLTEP-ZWKOTPCHSA-N 1 1 380.282 3.157 10 0 GGAEMO CCOc1ccc(NC(=O)C[NH2+]Cc2ccc(OC)cc2OC(F)F)cc1 ZINC000114764768 1412520705 /nfs/dbraw/zinc/52/07/05/1412520705.db2.gz FUHUHEVJGRKPOY-UHFFFAOYSA-N 1 1 380.391 3.424 10 0 GGAEMO C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)N1CCC([N@@H+](C)CCCO)CC1 ZINC000115548577 1412705278 /nfs/dbraw/zinc/70/52/78/1412705278.db2.gz GVIKQRWDYXHLQK-AWEZNQCLSA-N 1 1 378.904 3.230 10 0 GGAEMO CCN(C(C)=O)c1nc(C[NH2+][C@H]2CCN(c3ccc(F)cc3F)C2)cs1 ZINC000115617241 1412734588 /nfs/dbraw/zinc/73/45/88/1412734588.db2.gz BWAHWHNGDTYBTK-AWEZNQCLSA-N 1 1 380.464 3.163 10 0 GGAEMO CCN(C(C)=O)c1nc(C[NH2+][C@@H]2CCN(c3ccc(F)cc3F)C2)cs1 ZINC000115617240 1412735138 /nfs/dbraw/zinc/73/51/38/1412735138.db2.gz BWAHWHNGDTYBTK-CQSZACIVSA-N 1 1 380.464 3.163 10 0 GGAEMO CC(C)[C@@H](C[NH2+]Cc1c(Cl)n(C)nc1-c1ccccc1)N1CCN(C)CC1 ZINC000116334191 1412850636 /nfs/dbraw/zinc/85/06/36/1412850636.db2.gz HKMGJSKLGFCXGS-LJQANCHMSA-N 1 1 389.975 3.102 10 0 GGAEMO CCc1nn(C)c(Cl)c1C[NH2+]Cc1cccc(CN2CCO[C@@H](C)C2)c1 ZINC000116336260 1412851114 /nfs/dbraw/zinc/85/11/14/1412851114.db2.gz FJXQXQOPTKDEBS-HNNXBMFYSA-N 1 1 376.932 3.146 10 0 GGAEMO C[C@H]1CN(Cc2ccc(C[NH2+]Cc3ccc4c(c3)OCCO4)cc2)C[C@H](C)O1 ZINC000119682988 1413530510 /nfs/dbraw/zinc/53/05/10/1413530510.db2.gz CJPADUVPXZIXRT-ROUUACIJSA-N 1 1 382.504 3.357 10 0 GGAEMO CCc1c(C(=O)N2CCN(c3cc[nH+]cc3Cl)CC2)cnn1-c1ccccc1 ZINC000119835449 1413586850 /nfs/dbraw/zinc/58/68/50/1413586850.db2.gz XVEWBMHXKCXRTE-UHFFFAOYSA-N 1 1 395.894 3.446 10 0 GGAEMO CC(C)(C)OC(=O)N[C@H]1CC[N@@H+](C[C@@H](O)c2ccc(Br)cc2)C1 ZINC000120102266 1413688435 /nfs/dbraw/zinc/68/84/35/1413688435.db2.gz GXVURWXRVCMCLW-LSDHHAIUSA-N 1 1 385.302 3.082 10 0 GGAEMO COc1cc2c(c(CNc3cccc(C[N@H+]4CCC[C@@H]4C(N)=O)c3)c1)O[C@@H](C)C2 ZINC000120124278 1413696894 /nfs/dbraw/zinc/69/68/94/1413696894.db2.gz FRZKRWZONILQHM-YCRPNKLZSA-N 1 1 395.503 3.080 10 0 GGAEMO NC(=O)[C@H]1CCC[N@H+]1Cc1cccc(NCc2cc3ccccc3[nH]c2=O)c1 ZINC000120136631 1413702614 /nfs/dbraw/zinc/70/26/14/1413702614.db2.gz FLFXEIROOVVFMD-HXUWFJFHSA-N 1 1 376.460 3.002 10 0 GGAEMO NC(=O)[C@@H]1CCC[N@H+]1Cc1cccc(NCc2ccc(F)c3cccnc23)c1 ZINC000120144786 1413705079 /nfs/dbraw/zinc/70/50/79/1413705079.db2.gz CNJNLFGJYFGRBW-FQEVSTJZSA-N 1 1 378.451 3.436 10 0 GGAEMO CCN(C(=O)C[N@@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1)c1nc2ccccc2s1 ZINC000120217987 1413736082 /nfs/dbraw/zinc/73/60/82/1413736082.db2.gz GQOOBVDTDLJVMK-NVXWUHKLSA-N 1 1 383.521 3.429 10 0 GGAEMO CCN(C(=O)C[N@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1)c1nc2ccccc2s1 ZINC000120217987 1413736091 /nfs/dbraw/zinc/73/60/91/1413736091.db2.gz GQOOBVDTDLJVMK-NVXWUHKLSA-N 1 1 383.521 3.429 10 0 GGAEMO CN(CC1CC[NH+](C[C@@H](O)c2ccccc2)CC1)C(=O)c1[nH]nc2ccccc21 ZINC000177470130 1428753309 /nfs/dbraw/zinc/75/33/09/1428753309.db2.gz UKXPRBYTGPUYQB-OAQYLSRUSA-N 1 1 392.503 3.081 10 0 GGAEMO COc1ccc(CN(C)C(=O)C[NH2+][C@H](C)c2ccc(F)cc2F)cc1OC ZINC000120551816 1413841918 /nfs/dbraw/zinc/84/19/18/1413841918.db2.gz GMSUTPVJERMRKM-CYBMUJFWSA-N 1 1 378.419 3.291 10 0 GGAEMO COc1ccc(C[N@H+]2CC[C@H](N3CCOCC3)C2)cc1OCc1ccccc1 ZINC000120950374 1413957266 /nfs/dbraw/zinc/95/72/66/1413957266.db2.gz FBKBCXQHRZTRQT-NRFANRHFSA-N 1 1 382.504 3.181 10 0 GGAEMO COc1cc(C)c(C[NH2+][C@@H](c2nc(-c3nc[nH]n3)no2)C(C)(C)C)cc1OC ZINC000121045477 1413988200 /nfs/dbraw/zinc/98/82/00/1413988200.db2.gz GZUSMCYKQFEHAW-HNNXBMFYSA-N 1 1 386.456 3.057 10 0 GGAEMO CC(C)(C)[C@H]([NH2+]Cc1cccc(Br)c1)c1nc(-c2nc[nH]n2)no1 ZINC000121067948 1413995048 /nfs/dbraw/zinc/99/50/48/1413995048.db2.gz HTYKWRZRGWNOGO-GFCCVEGCSA-N 1 1 391.273 3.494 10 0 GGAEMO CN(C)C(=O)COc1cccc(C[NH2+]Cc2cc(F)ccc2Br)c1 ZINC000121399512 1414108036 /nfs/dbraw/zinc/10/80/36/1414108036.db2.gz GUNPUCKFJSUVLZ-UHFFFAOYSA-N 1 1 395.272 3.345 10 0 GGAEMO Cc1nc(-c2cccc(NCc3cnc(N4CC[NH+](C)CC4)nc3)c2)oc1C ZINC000121499357 1414152661 /nfs/dbraw/zinc/15/26/61/1414152661.db2.gz DVQURPXDEDGDBH-UHFFFAOYSA-N 1 1 378.480 3.112 10 0 GGAEMO C[C@@H](NC(=O)N1CC[NH+](Cc2ccccc2)CC1)c1noc(-c2ccccc2)n1 ZINC000121523235 1414161430 /nfs/dbraw/zinc/16/14/30/1414161430.db2.gz HXHZKVRDYXNYMI-QGZVFWFLSA-N 1 1 391.475 3.325 10 0 GGAEMO O=C(NCc1csc(-c2ccco2)n1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000121608695 1414198448 /nfs/dbraw/zinc/19/84/48/1414198448.db2.gz DLMALMKUVJKTNQ-UHFFFAOYSA-N 1 1 382.489 3.431 10 0 GGAEMO CS(=O)(=O)Cc1ccccc1C[NH2+]Cc1cc(F)ccc1Br ZINC000121657661 1414214222 /nfs/dbraw/zinc/21/42/22/1414214222.db2.gz IDPNKGWZIPARPE-UHFFFAOYSA-N 1 1 386.286 3.423 10 0 GGAEMO O=C(Nc1cccc(C[NH2+]Cc2c(Cl)nc3ccccn32)c1)[C@H]1CCCO1 ZINC000121670126 1414217797 /nfs/dbraw/zinc/21/77/97/1414217797.db2.gz CDSYDYUEEGGWCD-QGZVFWFLSA-N 1 1 384.867 3.395 10 0 GGAEMO CC(=O)N1CSC[C@H]1C(=O)Nc1ccccc1C[N@H+](C)C1CCCCC1 ZINC000121788723 1414257550 /nfs/dbraw/zinc/25/75/50/1414257550.db2.gz CWZAXIIADFDNAK-IBGZPJMESA-N 1 1 375.538 3.311 10 0 GGAEMO COc1cc(CNc2cccc(C[NH+]3CCN(C)CC3)c2)cc(OC)c1OC ZINC000123982760 1414862284 /nfs/dbraw/zinc/86/22/84/1414862284.db2.gz GSHDHCLIMKPPIG-UHFFFAOYSA-N 1 1 385.508 3.072 10 0 GGAEMO COc1ccc(CN(C)C(=O)C[N@H+]2CC[C@@H](Cc3ccccc3)C2)cc1OC ZINC000124249508 1414919905 /nfs/dbraw/zinc/91/99/05/1414919905.db2.gz FGQALWLAIRDUPR-FQEVSTJZSA-N 1 1 382.504 3.227 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCC1CCN(C(=O)C(=O)Nc2ccc3c(c2)CCO3)CC1 ZINC000177766191 1428853226 /nfs/dbraw/zinc/85/32/26/1428853226.db2.gz CFAMEXSGFLVPLZ-QGZVFWFLSA-N 1 1 399.535 3.063 10 0 GGAEMO COC(=O)Nc1ccc(CNC(=O)N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000125049384 1415099779 /nfs/dbraw/zinc/09/97/79/1415099779.db2.gz GOIQHEZZGASIIB-QFBILLFUSA-N 1 1 386.496 3.023 10 0 GGAEMO COC(=O)Nc1ccc(CNC(=O)N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000125049146 1415099808 /nfs/dbraw/zinc/09/98/08/1415099808.db2.gz GOIQHEZZGASIIB-APWZRJJASA-N 1 1 386.496 3.023 10 0 GGAEMO Cc1nnc(-c2ccccc2C(=O)NC2CCN(c3cccc(C)[nH+]3)CC2)o1 ZINC000125253961 1415143592 /nfs/dbraw/zinc/14/35/92/1415143592.db2.gz JHACCOMPFLHQBF-UHFFFAOYSA-N 1 1 377.448 3.147 10 0 GGAEMO CC[NH+]1CCN(CCCCNC(=O)N(C)[C@@H](C)Cc2ccc(Cl)cc2)CC1 ZINC000125334587 1415167188 /nfs/dbraw/zinc/16/71/88/1415167188.db2.gz BNYAXLQWSXRHEI-SFHVURJKSA-N 1 1 394.991 3.330 10 0 GGAEMO Cc1cc(NC(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)ccc1C(=O)N(C)C ZINC000177869772 1428878301 /nfs/dbraw/zinc/87/83/01/1428878301.db2.gz DVLSVUORAUUDSB-SFHVURJKSA-N 1 1 394.519 3.435 10 0 GGAEMO Cc1cc(NC(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C)ccc1C(=O)N(C)C ZINC000177869772 1428878304 /nfs/dbraw/zinc/87/83/04/1428878304.db2.gz DVLSVUORAUUDSB-SFHVURJKSA-N 1 1 394.519 3.435 10 0 GGAEMO COc1ccc(C[NH2+]Cc2ccnc(N3CCN(C)CC3)c2)c2ccccc12 ZINC000126051742 1415345279 /nfs/dbraw/zinc/34/52/79/1415345279.db2.gz GRCLMOIHPIYGAB-UHFFFAOYSA-N 1 1 376.504 3.285 10 0 GGAEMO CC(C)[C@H](NC(=O)C[N@H+](C)C[C@@H]1CCCCO1)c1ccc2c(c1)OCCCO2 ZINC000126085419 1415353870 /nfs/dbraw/zinc/35/38/70/1415353870.db2.gz DPMUEJRSGJKJHX-AVRDEDQJSA-N 1 1 390.524 3.162 10 0 GGAEMO CC(C)[C@H](NC(=O)C[N@@H+](C)C[C@@H]1CCCCO1)c1ccc2c(c1)OCCCO2 ZINC000126085419 1415353878 /nfs/dbraw/zinc/35/38/78/1415353878.db2.gz DPMUEJRSGJKJHX-AVRDEDQJSA-N 1 1 390.524 3.162 10 0 GGAEMO CC(C)[C@@H](NC(=O)C[N@H+](C)C[C@@H]1CCCCO1)c1ccc2c(c1)OCCCO2 ZINC000126085650 1415354008 /nfs/dbraw/zinc/35/40/08/1415354008.db2.gz DPMUEJRSGJKJHX-PGRDOPGGSA-N 1 1 390.524 3.162 10 0 GGAEMO CC(C)[C@@H](NC(=O)C[N@@H+](C)C[C@@H]1CCCCO1)c1ccc2c(c1)OCCCO2 ZINC000126085650 1415354016 /nfs/dbraw/zinc/35/40/16/1415354016.db2.gz DPMUEJRSGJKJHX-PGRDOPGGSA-N 1 1 390.524 3.162 10 0 GGAEMO COc1ccccc1-c1nn(C)cc1C(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000126713589 1415536121 /nfs/dbraw/zinc/53/61/21/1415536121.db2.gz DHWQKONRIHGIKU-UHFFFAOYSA-N 1 1 390.487 3.054 10 0 GGAEMO CC(C)Oc1ccccc1C[NH2+]Cc1ccccc1OCCN1CCOCC1 ZINC000126763671 1415552299 /nfs/dbraw/zinc/55/22/99/1415552299.db2.gz CKHBABOXQVKQQI-UHFFFAOYSA-N 1 1 384.520 3.475 10 0 GGAEMO CNS(=O)(=O)c1cccc([C@H](C)[NH2+]Cc2cnc(-c3ccc(C)o3)s2)c1 ZINC000126804583 1415564389 /nfs/dbraw/zinc/56/43/89/1415564389.db2.gz DJBWLGGVXLVWQP-ZDUSSCGKSA-N 1 1 391.518 3.470 10 0 GGAEMO CNS(=O)(=O)c1cccc([C@@H](C)[NH2+]Cc2cnc(-c3ccc(C)o3)s2)c1 ZINC000126804743 1415565252 /nfs/dbraw/zinc/56/52/52/1415565252.db2.gz DJBWLGGVXLVWQP-CYBMUJFWSA-N 1 1 391.518 3.470 10 0 GGAEMO COc1cc(CNc2ccc(C[N@H+]3CCC[C@@H](C(N)=O)C3)cc2)cc(OC)c1 ZINC000127489999 1415799804 /nfs/dbraw/zinc/79/98/04/1415799804.db2.gz AHFJOUFFNKESIB-GOSISDBHSA-N 1 1 383.492 3.013 10 0 GGAEMO Cc1ccc(NCCCNC(=O)C(O)(c2ccccc2)c2ccccc2)[nH+]c1 ZINC000127808025 1415854764 /nfs/dbraw/zinc/85/47/64/1415854764.db2.gz BCRZHSDAXMHWSS-UHFFFAOYSA-N 1 1 375.472 3.244 10 0 GGAEMO Cc1nn(C)c(OCC(F)(F)F)c1C[N@@H+]1CC[C@@H](CNc2cccc(C)n2)C1 ZINC000128284958 1415955001 /nfs/dbraw/zinc/95/50/01/1415955001.db2.gz STNUIPXGIPHKOI-HNNXBMFYSA-N 1 1 397.445 3.307 10 0 GGAEMO Cc1nn(C)c(OCC(F)(F)F)c1C[N@H+]1CC[C@@H](CNc2cccc(C)n2)C1 ZINC000128284958 1415955003 /nfs/dbraw/zinc/95/50/03/1415955003.db2.gz STNUIPXGIPHKOI-HNNXBMFYSA-N 1 1 397.445 3.307 10 0 GGAEMO COc1ccc(Br)c(C[NH2+]Cc2ccccc2CS(C)(=O)=O)c1 ZINC000128653414 1416034309 /nfs/dbraw/zinc/03/43/09/1416034309.db2.gz GOFAMSDZLFIAOE-UHFFFAOYSA-N 1 1 398.322 3.292 10 0 GGAEMO CC(C)[C@H]([NH2+]Cc1cccc(-c2ccccn2)c1)c1nc(-c2nc[nH]n2)no1 ZINC000129142800 1416155645 /nfs/dbraw/zinc/15/56/45/1416155645.db2.gz IETITZDLQOAHBH-KRWDZBQOSA-N 1 1 375.436 3.404 10 0 GGAEMO C[C@H]1CC[N@@H+](CC(=O)Nc2ccc(N3CCCCC3)cc2)C[C@@H]1n1ccnc1 ZINC000129559353 1416228457 /nfs/dbraw/zinc/22/84/57/1416228457.db2.gz HNTKVMPZFJGQKY-RXVVDRJESA-N 1 1 381.524 3.395 10 0 GGAEMO CC(C)OCc1cccc(CNC(=O)C[N@H+]2CC[C@@H](C)[C@@H](n3ccnc3)C2)c1 ZINC000129753062 1416258081 /nfs/dbraw/zinc/25/80/81/1416258081.db2.gz DMFSSDZEIXCDQJ-NQIIRXRSSA-N 1 1 384.524 3.007 10 0 GGAEMO CC(C)OCc1cccc(CNC(=O)C[N@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)c1 ZINC000129753267 1416258602 /nfs/dbraw/zinc/25/86/02/1416258602.db2.gz DMFSSDZEIXCDQJ-RXVVDRJESA-N 1 1 384.524 3.007 10 0 GGAEMO Cn1c(C[NH2+]Cc2ccc(NC(N)=O)cc2)nc2cc(C(F)(F)F)ccc21 ZINC000130431359 1416377342 /nfs/dbraw/zinc/37/73/42/1416377342.db2.gz CQDWVMWTWBMFAT-UHFFFAOYSA-N 1 1 377.370 3.373 10 0 GGAEMO CCOc1cc(Cl)ccc1C[NH2+]Cc1ccccc1OCC(=O)N(C)C ZINC000130614855 1416410287 /nfs/dbraw/zinc/41/02/87/1416410287.db2.gz GBGGNLCNMXNWGQ-UHFFFAOYSA-N 1 1 376.884 3.496 10 0 GGAEMO COc1cc(OC)cc([C@@H](O)CNC2CC[NH+](CCc3ccccc3)CC2)c1 ZINC000130918710 1416480923 /nfs/dbraw/zinc/48/09/23/1416480923.db2.gz HMTWEESFYVEYEW-QHCPKHFHSA-N 1 1 384.520 3.034 10 0 GGAEMO COc1ccc(CNC2CC[NH+]([C@@H](C)c3ccncc3)CC2)c(OC)c1OC ZINC000131010282 1416495728 /nfs/dbraw/zinc/49/57/28/1416495728.db2.gz CTJYJLKQVZUVEY-INIZCTEOSA-N 1 1 385.508 3.423 10 0 GGAEMO CN(C)S(=O)(=O)c1ccccc1C[NH2+]Cc1cnc(C2CCCC2)s1 ZINC000135855386 1417274073 /nfs/dbraw/zinc/27/40/73/1417274073.db2.gz ASCZLYHQGBXKBK-UHFFFAOYSA-N 1 1 379.551 3.341 10 0 GGAEMO CCN(C(C)=O)c1nc(C[NH2+][C@@H]2CCCN(c3ccccc3F)C2)cs1 ZINC000136126886 1417294270 /nfs/dbraw/zinc/29/42/70/1417294270.db2.gz DRFCHALOLRCXID-OAHLLOKOSA-N 1 1 376.501 3.414 10 0 GGAEMO O[C@H]1CCCC[C@H]1[NH+]1CCC(NCc2ccc(OCC(F)(F)F)cc2)CC1 ZINC000136591979 1417330388 /nfs/dbraw/zinc/33/03/88/1417330388.db2.gz HYZDGEDBUMTMAM-MOPGFXCFSA-N 1 1 386.458 3.485 10 0 GGAEMO O[C@@H]1CCCC[C@H]1[NH+]1CCC(NCc2ccc(Oc3cnccn3)cc2)CC1 ZINC000136599592 1417331525 /nfs/dbraw/zinc/33/15/25/1417331525.db2.gz BWGVTWKVEKZQBU-NHCUHLMSSA-N 1 1 382.508 3.126 10 0 GGAEMO CCN(Cc1ccc(OC)c(OC)c1)C(=O)C[N@@H+](C)C1Cc2ccccc2C1 ZINC000138432796 1417414596 /nfs/dbraw/zinc/41/45/96/1417414596.db2.gz BOTUGFDOALUVRN-UHFFFAOYSA-N 1 1 382.504 3.152 10 0 GGAEMO CC(C)(C)OC(=O)NCCCCCC(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000144901724 1417676129 /nfs/dbraw/zinc/67/61/29/1417676129.db2.gz ATVMOPIHKDDHBJ-UHFFFAOYSA-N 1 1 389.540 3.416 10 0 GGAEMO CN(C)c1cccc2c1cccc2S(=O)(=O)N1CC[NH+](C(C)(C)C)CC1 ZINC000147363944 1417746109 /nfs/dbraw/zinc/74/61/09/1417746109.db2.gz HANJXWSDQALJFU-UHFFFAOYSA-N 1 1 375.538 3.011 10 0 GGAEMO COc1ncccc1C[NH2+][C@@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000151163935 1417885826 /nfs/dbraw/zinc/88/58/26/1417885826.db2.gz FEWVRCQAOODZNI-INIZCTEOSA-N 1 1 389.521 3.116 10 0 GGAEMO CCOCc1cc(C[N@H+]2CCCN(Cc3cscn3)CC2)ccc1OC ZINC000179413862 1429364898 /nfs/dbraw/zinc/36/48/98/1429364898.db2.gz BGRCNUAHHVGPGS-UHFFFAOYSA-N 1 1 375.538 3.396 10 0 GGAEMO C[C@@H]([NH2+][C@@H](C)c1ccc(F)cc1Cl)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1 ZINC000179563492 1429435976 /nfs/dbraw/zinc/43/59/76/1429435976.db2.gz CFHOLBQXICQJQW-VHSXEESVSA-N 1 1 376.819 3.327 10 0 GGAEMO 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3.431 10 0 GGAEMO c1ccc(-c2nc3ccccn3c2C[N@@H+]2CCC[C@@H]2CN2CCOCC2)cc1 ZINC000156996646 1423899581 /nfs/dbraw/zinc/89/95/81/1423899581.db2.gz AKEJNFIDQFFUCM-HXUWFJFHSA-N 1 1 376.504 3.298 10 0 GGAEMO COc1cc(CNc2ccc(CC(=O)N3CC[NH+](C)CC3)cc2)ccc1SC ZINC000157123500 1423931012 /nfs/dbraw/zinc/93/10/12/1423931012.db2.gz FGFGCKRTTCWWSH-UHFFFAOYSA-N 1 1 399.560 3.346 10 0 GGAEMO CC(C)C[N@H+]1CC[C@H](CNC(=O)NCc2ccc(OCc3ccccn3)cc2)C1 ZINC000157592815 1424045188 /nfs/dbraw/zinc/04/51/88/1424045188.db2.gz DVQHLXMSUYEULL-HXUWFJFHSA-N 1 1 396.535 3.438 10 0 GGAEMO Cc1ccc(N2CCC(NC(=O)[C@H]3COc4ccc(Cl)cc4C3)CC2)[nH+]c1 ZINC000157898985 1424115264 /nfs/dbraw/zinc/11/52/64/1424115264.db2.gz JSHBXUABHQNPSI-MRXNPFEDSA-N 1 1 385.895 3.380 10 0 GGAEMO CC(C)(C)OC(=O)N1CCc2cccc(C[NH+]3CCN(c4cnccn4)CC3)c21 ZINC000157914064 1424118491 /nfs/dbraw/zinc/11/84/91/1424118491.db2.gz PDPOTWPLOBNSLI-UHFFFAOYSA-N 1 1 395.507 3.096 10 0 GGAEMO CC(C)c1ccc([C@H](C)CC(=O)NCCC[N@H+]2CCC[C@@H]2C(=O)N(C)C)cc1 ZINC000158137774 1424176384 /nfs/dbraw/zinc/17/63/84/1424176384.db2.gz AHXGGPYHCZDVKN-WIYYLYMNSA-N 1 1 387.568 3.363 10 0 GGAEMO Cc1ccc(OC[C@H](O)C[N@H+]2CC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C2)cc1 ZINC000158369915 1424238382 /nfs/dbraw/zinc/23/83/82/1424238382.db2.gz BSCIHDDXACLYIP-GCJKJVERSA-N 1 1 390.524 3.068 10 0 GGAEMO C[C@@H]1CC[N@@H+](CC(=O)N(C)Cc2ccc(OC(F)F)cc2)C[C@@H]1n1ccnc1 ZINC000159018592 1424397076 /nfs/dbraw/zinc/39/70/76/1424397076.db2.gz GDDIUKQFKOCAKR-QAPCUYQASA-N 1 1 392.450 3.026 10 0 GGAEMO O=C(Nc1ccnn1Cc1ccc(Cl)c(F)c1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000160669058 1424624101 /nfs/dbraw/zinc/62/41/01/1424624101.db2.gz UBOIZTWRSWUILI-HNNXBMFYSA-N 1 1 391.878 3.426 10 0 GGAEMO CN1CCN(c2cc(C[NH2+]Cc3cc(F)cc(C(F)(F)F)c3)ccn2)CC1 ZINC000162049984 1424811976 /nfs/dbraw/zinc/81/19/76/1424811976.db2.gz AFYGQMAAVHFUOR-UHFFFAOYSA-N 1 1 382.405 3.281 10 0 GGAEMO Cc1cc(=O)n(C)cc1NC(=O)NCc1ccc(C[N@@H+]2CCCC[C@@H]2C)cc1 ZINC000162297351 1424835447 /nfs/dbraw/zinc/83/54/47/1424835447.db2.gz CQQSLBWLSIDHKG-KRWDZBQOSA-N 1 1 382.508 3.390 10 0 GGAEMO Cn1c(C[NH2+][C@@H](CN2CCOCC2)c2ccccc2)nc2cc(Cl)ccc21 ZINC000162424601 1424849861 /nfs/dbraw/zinc/84/98/61/1424849861.db2.gz AWWKBRRIPQDUQW-IBGZPJMESA-N 1 1 384.911 3.390 10 0 GGAEMO COC(=O)c1ccc(C)c(NC(=O)[C@H](C)[NH+]2CCC(OC(C)(C)C)CC2)c1 ZINC000162588922 1424869866 /nfs/dbraw/zinc/86/98/66/1424869866.db2.gz CPFCMGZPHMSGAE-HNNXBMFYSA-N 1 1 376.497 3.388 10 0 GGAEMO c1ccc(CCN2CCC([NH2+][C@@H](CN3CCOCC3)c3ccccc3)CC2)cc1 ZINC000163691927 1425034828 /nfs/dbraw/zinc/03/48/28/1425034828.db2.gz BRGHNMSWPDXHMU-VWLOTQADSA-N 1 1 393.575 3.357 10 0 GGAEMO CC(=O)NCCC[NH+]1CCN(Cc2ccc(-c3cccc(F)c3)s2)CC1 ZINC000164626815 1425130595 /nfs/dbraw/zinc/13/05/95/1425130595.db2.gz GQCINCPLVOMGIP-UHFFFAOYSA-N 1 1 375.513 3.198 10 0 GGAEMO O=C(Nc1ccc(Br)nc1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000165833899 1425197966 /nfs/dbraw/zinc/19/79/66/1425197966.db2.gz FKDUUHBMLKTJIA-UHFFFAOYSA-N 1 1 375.270 3.194 10 0 GGAEMO O=C1[C@H]2C[N@H+](Cc3ccc(Cl)c(F)c3)C[C@H]2C(=O)N1CCc1ccccc1 ZINC000169756899 1425247489 /nfs/dbraw/zinc/24/74/89/1425247489.db2.gz OFEROKYFDRGYOI-CALCHBBNSA-N 1 1 386.854 3.139 10 0 GGAEMO Cc1ccsc1C[N@H+]1C[C@H](C(=O)NCCc2ccncc2)C2(C1)CCOCC2 ZINC000169756816 1425247697 /nfs/dbraw/zinc/24/76/97/1425247697.db2.gz FINDQKNDQCASHK-LJQANCHMSA-N 1 1 399.560 3.039 10 0 GGAEMO COc1cccc(C(=O)N2CCC3(CC2)[NH2+]Cc2ccccc2-n2ccnc23)c1 ZINC000169763801 1425249698 /nfs/dbraw/zinc/24/96/98/1425249698.db2.gz MWXSAYPYMACIOE-UHFFFAOYSA-N 1 1 388.471 3.116 10 0 GGAEMO O=C(Cc1ccc(F)cc1)N1CCC2(CC1)[NH2+]Cc1ccccc1-n1ccnc12 ZINC000169763816 1425249761 /nfs/dbraw/zinc/24/97/61/1425249761.db2.gz VXBABCCRSHLWKI-UHFFFAOYSA-N 1 1 390.462 3.175 10 0 GGAEMO Cc1ccsc1C(=O)N1CCC2(CC1)[NH2+]Cc1ccccc1-n1ccnc12 ZINC000169769983 1425251338 /nfs/dbraw/zinc/25/13/38/1425251338.db2.gz BYXCMOKNAGODBU-UHFFFAOYSA-N 1 1 378.501 3.477 10 0 GGAEMO O=C(NCc1ccc(F)cc1)N1CC(c2noc([C@H]3CCC[N@H+]3CC3CC3)n2)C1 ZINC000169782970 1425256065 /nfs/dbraw/zinc/25/60/65/1425256065.db2.gz AAAVPVNYMJAZGE-GOSISDBHSA-N 1 1 399.470 3.065 10 0 GGAEMO CCOC(=O)CCNC(=O)N1CCC2(C[N@@H+](C(C)C)[C@@H]2c2ccccc2)CC1 ZINC000169786999 1425256935 /nfs/dbraw/zinc/25/69/35/1425256935.db2.gz RZMVTHNLQIWDIS-HXUWFJFHSA-N 1 1 387.524 3.197 10 0 GGAEMO COC[C@@H]1C[N@H+](C2CCC2)CC12CCN(C(=O)COc1cccc(C)c1)CC2 ZINC000169789880 1425257761 /nfs/dbraw/zinc/25/77/61/1425257761.db2.gz BTGMXDLGMFBEDC-IBGZPJMESA-N 1 1 386.536 3.113 10 0 GGAEMO C[NH+](C)C[C@H](NS(=O)(=O)Cc1cccc(C(F)(F)F)c1)c1ccccc1 ZINC000170657151 1425279279 /nfs/dbraw/zinc/27/92/79/1425279279.db2.gz IZGRMTCIDQKBFY-KRWDZBQOSA-N 1 1 386.439 3.428 10 0 GGAEMO C[N@@H+](CCCNC(=O)[C@H]1CCCC[C@@H]1C(=O)N1CCCC1)Cc1ccccc1 ZINC000170682617 1425295527 /nfs/dbraw/zinc/29/55/27/1425295527.db2.gz CNGXPWHIBKIYKO-SFTDATJTSA-N 1 1 385.552 3.054 10 0 GGAEMO C[N@@H+]1CCN(C(=O)c2ccc(Br)cc2Br)CC1(C)C ZINC000234324768 1433373745 /nfs/dbraw/zinc/37/37/45/1433373745.db2.gz FCIAQKKVNAIMSE-UHFFFAOYSA-N 1 1 390.119 3.378 10 0 GGAEMO C[N@H+]1CCN(C(=O)c2ccc(Br)cc2Br)CC1(C)C ZINC000234324768 1433373747 /nfs/dbraw/zinc/37/37/47/1433373747.db2.gz FCIAQKKVNAIMSE-UHFFFAOYSA-N 1 1 390.119 3.378 10 0 GGAEMO CCc1[nH+]ccn1[C@H]1CCCN(CC(=O)Nc2nc3c(cccc3OC)s2)C1 ZINC000171521913 1425713871 /nfs/dbraw/zinc/71/38/71/1425713871.db2.gz WRVLUJFRRXDHSU-AWEZNQCLSA-N 1 1 399.520 3.339 10 0 GGAEMO CC[N@@H+](C)[C@H](C(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccccc1 ZINC000171622165 1425761417 /nfs/dbraw/zinc/76/14/17/1425761417.db2.gz CJQPAWGPOHRIOG-MJGOQNOKSA-N 1 1 389.540 3.443 10 0 GGAEMO C[C@H]1CCCC[N@H+]1CCCNC(=O)NCC[C@@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000171703130 1425794020 /nfs/dbraw/zinc/79/40/20/1425794020.db2.gz AOXFSBNNNKNKKX-ZWKOTPCHSA-N 1 1 396.576 3.197 10 0 GGAEMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)NCCc1nc2ccccc2[nH]1 ZINC000172346907 1426010119 /nfs/dbraw/zinc/01/01/19/1426010119.db2.gz HCPNTAHTLYMTDC-KRWDZBQOSA-N 1 1 377.492 3.021 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)NCCc1nc2ccccc2[nH]1 ZINC000172346907 1426010123 /nfs/dbraw/zinc/01/01/23/1426010123.db2.gz HCPNTAHTLYMTDC-KRWDZBQOSA-N 1 1 377.492 3.021 10 0 GGAEMO O=C(C[N@@H+]1CCC[C@@H]1CN1CCOCC1)Nc1cccc(Oc2ccccc2)c1 ZINC000173686112 1426820836 /nfs/dbraw/zinc/82/08/36/1426820836.db2.gz FTLHKOWTANASDD-HXUWFJFHSA-N 1 1 395.503 3.214 10 0 GGAEMO O=C(C[N@H+]1CCC[C@@H]1CN1CCOCC1)Nc1cccc(Oc2ccccc2)c1 ZINC000173686112 1426820838 /nfs/dbraw/zinc/82/08/38/1426820838.db2.gz FTLHKOWTANASDD-HXUWFJFHSA-N 1 1 395.503 3.214 10 0 GGAEMO CCc1nc(NC(=O)CN(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)sc1C ZINC000173978962 1426922528 /nfs/dbraw/zinc/92/25/28/1426922528.db2.gz AAAQBJWUNDLYLQ-SFHVURJKSA-N 1 1 386.565 3.406 10 0 GGAEMO O=C(C[NH2+]Cc1cc(Cl)ccc1OC[C@H]1CCCO1)NC1CCCCC1 ZINC000174424193 1427150999 /nfs/dbraw/zinc/15/09/99/1427150999.db2.gz FQVCNVRPFNABQP-GOSISDBHSA-N 1 1 380.916 3.436 10 0 GGAEMO COc1cccc(CS(=O)(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@@H](C)C2)c1 ZINC000175844179 1427925938 /nfs/dbraw/zinc/92/59/38/1427925938.db2.gz 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3.254 10 0 GGAEMO C[C@@H](C(=O)N(C)Cc1c(F)cccc1Cl)[N@@H+]1C[C@H](C)OC2(CCOCC2)C1 ZINC000279658390 1435525585 /nfs/dbraw/zinc/52/55/85/1435525585.db2.gz CILFCXQIHLVPDY-GJZGRUSLSA-N 1 1 398.906 3.096 10 0 GGAEMO C[C@@H](C(=O)N(C)Cc1c(F)cccc1Cl)[N@H+]1C[C@H](C)OC2(CCOCC2)C1 ZINC000279658390 1435525589 /nfs/dbraw/zinc/52/55/89/1435525589.db2.gz CILFCXQIHLVPDY-GJZGRUSLSA-N 1 1 398.906 3.096 10 0 GGAEMO CC(=O)N1CCC[C@@H](CNc2[nH+]cnc3c2c(C)c(C)n3Cc2ccco2)C1 ZINC000280908671 1435740454 /nfs/dbraw/zinc/74/04/54/1435740454.db2.gz GGBGMLVSZAERKF-KRWDZBQOSA-N 1 1 381.480 3.360 10 0 GGAEMO C[C@]1(O)CCOC[C@@H]1[C@@H]1CCC[N@H+]1CCOc1ccc(OC(F)(F)F)cc1 ZINC000284705438 1436041468 /nfs/dbraw/zinc/04/14/68/1436041468.db2.gz GPVPNOUFPDHBJK-SQNIBIBYSA-N 1 1 389.414 3.216 10 0 GGAEMO OCC1([NH2+]Cc2csc(COc3ccc(F)cc3)n2)Cc2ccccc2C1 ZINC000512306078 1126095583 /nfs/dbraw/zinc/09/55/83/1126095583.db2.gz YBZUPWLLTSYFCG-UHFFFAOYSA-N 1 1 384.476 3.481 10 0 GGAEMO Cc1nn(-c2ccncc2)cc1C[NH2+][C@@H](Cc1ccccc1)[C@@H](O)C(F)(F)F ZINC000680121101 1126105562 /nfs/dbraw/zinc/10/55/62/1126105562.db2.gz QYMJUBHYXDSRSS-RBUKOAKNSA-N 1 1 390.409 3.200 10 0 GGAEMO CC(=O)N(c1nc(C[NH2+][C@](C)(CO)Cc2ccc(Cl)cc2)cs1)C1CC1 ZINC000865772549 1126116719 /nfs/dbraw/zinc/11/67/19/1126116719.db2.gz NRTFUGRGMBDURD-IBGZPJMESA-N 1 1 393.940 3.395 10 0 GGAEMO Cc1cc(C)cc(OCc2noc(C[NH2+][C@@](C)(CO)Cc3ccc(F)cc3)n2)c1 ZINC001308118358 1126163887 /nfs/dbraw/zinc/16/38/87/1126163887.db2.gz RQKYJSCDLQLEDR-JOCHJYFZSA-N 1 1 399.466 3.488 10 0 GGAEMO COc1cc(-c2noc(C[NH2+][C@](C)(CO)Cc3ccccc3F)n2)ccc1C ZINC001308117118 1126163442 /nfs/dbraw/zinc/16/34/42/1126163442.db2.gz HETHIQBBJOWVMW-NRFANRHFSA-N 1 1 385.439 3.276 10 0 GGAEMO O[C@H]([C@@H](Cc1ccccc1)[NH2+]Cc1ccncc1Br)C(F)(F)F ZINC001560100051 1126207712 /nfs/dbraw/zinc/20/77/12/1126207712.db2.gz CWLAWDLZFANXCA-HUUCEWRRSA-N 1 1 389.215 3.468 10 0 GGAEMO NC(=O)C1CC[NH+](Cc2cc(F)cc3c2O[C@H](c2ccsc2)OC3)CC1 ZINC000016694833 210195411 /nfs/dbraw/zinc/19/54/11/210195411.db2.gz KZLAEMWAPMJBLQ-LJQANCHMSA-N 1 1 376.453 3.192 10 0 GGAEMO C[N@@H+]1C[C@H]2CN(C(=O)c3ccc(-c4ccc5nc(N)sc5c4)cc3)C[C@H]2C1 ZINC000426518149 529823517 /nfs/dbraw/zinc/82/35/17/529823517.db2.gz AXRNNVQEIVXMAW-CALCHBBNSA-N 1 1 378.501 3.009 10 0 GGAEMO Cc1cccc(N2CC[NH+](CCNC(=O)C3=Cc4ccccc4OC3)CC2)c1C ZINC000015786347 210171211 /nfs/dbraw/zinc/17/12/11/210171211.db2.gz YVGPRZTVKHJVTP-UHFFFAOYSA-N 1 1 391.515 3.018 10 0 GGAEMO CCn1nc(C(=O)NC[C@H](c2ccccc2Cl)[NH+](C)C)c2ccccc2c1=O ZINC000015787895 210171242 /nfs/dbraw/zinc/17/12/42/210171242.db2.gz ATZDEOGLXBTIEP-GOSISDBHSA-N 1 1 398.894 3.103 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)C1=Cc2cc(Br)ccc2OC1 ZINC000015786378 210170760 /nfs/dbraw/zinc/17/07/60/210170760.db2.gz XXOUCPZILQGRMA-CYBMUJFWSA-N 1 1 379.298 3.216 10 0 GGAEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCCNC(=O)c1ccc2c(c1)nc1n(c2=O)CCCC1 ZINC000015677582 210163005 /nfs/dbraw/zinc/16/30/05/210163005.db2.gz BSJISEBNWQHZEE-CALCHBBNSA-N 1 1 396.535 3.116 10 0 GGAEMO CN(C[C@H]1COc2ccccc2O1)C(=O)C[N@@H+](C)[C@@H]1CCCc2ccccc21 ZINC000015291772 210155865 /nfs/dbraw/zinc/15/58/65/210155865.db2.gz PCXQMOCMSIGFOQ-AZUAARDMSA-N 1 1 380.488 3.294 10 0 GGAEMO CN1C(=O)[C@H]2[C@H](C(=O)c3ccc(Cl)cc3)[N@H+]3C=Cc4ccccc4[C@H]3[C@H]2C1=O ZINC000252596016 530046394 /nfs/dbraw/zinc/04/63/94/530046394.db2.gz CFNRMTORAZLREV-ZSYWTGECSA-N 1 1 392.842 3.164 10 0 GGAEMO CN1C(=O)[C@H]2[C@H](C(=O)c3ccc(Cl)cc3)[N@@H+]3C=Cc4ccccc4[C@H]3[C@H]2C1=O ZINC000252596016 530046395 /nfs/dbraw/zinc/04/63/95/530046395.db2.gz CFNRMTORAZLREV-ZSYWTGECSA-N 1 1 392.842 3.164 10 0 GGAEMO CCOC(=O)[C@@]1(Cc2ccccc2)CCC[N@@H+](Cc2cccc(OCCO)c2)C1 ZINC000014959349 210132981 /nfs/dbraw/zinc/13/29/81/210132981.db2.gz SBGJUJXKYVLOBV-XMMPIXPASA-N 1 1 397.515 3.446 10 0 GGAEMO O=C(C1CCN(Cc2ccco2)CC1)N1CC[C@]2(C1)CCC[N@H+](CC1CC1)C2 ZINC000014951654 210131825 /nfs/dbraw/zinc/13/18/25/210131825.db2.gz NOFUZLQHRIZOSM-HSZRJFAPSA-N 1 1 385.552 3.216 10 0 GGAEMO O=C(C1CCN(Cc2ccco2)CC1)N1CC[C@]2(C1)CCC[N@@H+](CC1CC1)C2 ZINC000014951654 210131829 /nfs/dbraw/zinc/13/18/29/210131829.db2.gz NOFUZLQHRIZOSM-HSZRJFAPSA-N 1 1 385.552 3.216 10 0 GGAEMO CC(C)n1cc2c3c1cccc3[C@@H]1C[C@@H](C(=O)O[C@@H](C)[C@H](C)O)C[N@H+](C)[C@@H]1C2 ZINC000014952188 210130413 /nfs/dbraw/zinc/13/04/13/210130413.db2.gz JQYLIGHHVGCTPR-BQRMZNRMSA-N 1 1 384.520 3.495 10 0 in-vitro GGAEMO COc1ccc(CCC2CC[NH+](CN3C(=O)NC4(CCCC4)C3=O)CC2)cc1 ZINC000014187278 210108965 /nfs/dbraw/zinc/10/89/65/210108965.db2.gz BRMSSYKXPFTWRU-UHFFFAOYSA-N 1 1 385.508 3.162 10 0 GGAEMO C[C@H](c1ccccc1)[NH+]1CCN(C(=O)CSc2nnc3n2CCCCC3)CC1 ZINC000014122794 210104353 /nfs/dbraw/zinc/10/43/53/210104353.db2.gz BGFATYHCYDAOBC-QGZVFWFLSA-N 1 1 399.564 3.002 10 0 GGAEMO C[C@@H](c1ccccc1)[NH+]1CCN(C(=O)CSc2nnc3n2CCCCC3)CC1 ZINC000014122798 210103007 /nfs/dbraw/zinc/10/30/07/210103007.db2.gz BGFATYHCYDAOBC-KRWDZBQOSA-N 1 1 399.564 3.002 10 0 GGAEMO O=C(C[NH2+][C@H](c1cccs1)c1ccccc1)N1CC(=O)Nc2ccccc21 ZINC000014141752 210106518 /nfs/dbraw/zinc/10/65/18/210106518.db2.gz BKPBSIKOICFIKE-NRFANRHFSA-N 1 1 377.469 3.412 10 0 GGAEMO CC(C)n1cc2c3c1cccc3[C@H]1C[C@@H](C(=O)O[C@@H](C)[C@H](C)O)C[N@H+](C)[C@@H]1C2 ZINC000013783296 210089766 /nfs/dbraw/zinc/08/97/66/210089766.db2.gz JQYLIGHHVGCTPR-BVRWACBHSA-N 1 1 384.520 3.495 10 0 in-vitro GGAEMO C[C@@H]1C[C@H](C)C[N@H+](CC(=O)N(C)CC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000013056186 210049138 /nfs/dbraw/zinc/04/91/38/210049138.db2.gz QJVKAERWPJKSHR-BETUJISGSA-N 1 1 386.323 3.368 10 0 GGAEMO Cc1cc(C)c(OCC(=O)NCc2ccc(C[NH+]3CCOCC3)cc2)c(C)c1 ZINC000012999544 210043870 /nfs/dbraw/zinc/04/38/70/210043870.db2.gz PWBMFBFLEAPDOG-UHFFFAOYSA-N 1 1 382.504 3.139 10 0 GGAEMO O=C(c1ccc(=O)[nH]c1)N1CC[NH+](Cc2ccc(-c3ccccc3)s2)CC1 ZINC000012980653 210039296 /nfs/dbraw/zinc/03/92/96/210039296.db2.gz AUZCNEDIVJDABV-UHFFFAOYSA-N 1 1 379.485 3.061 10 0 GGAEMO CN(C(=O)C[N@@H+]1CCCN(c2ccc(C(F)(F)F)cn2)CC1)c1ccccc1 ZINC000012980944 210039087 /nfs/dbraw/zinc/03/90/87/210039087.db2.gz NNXKBJMOOFLQGJ-UHFFFAOYSA-N 1 1 392.425 3.276 10 0 GGAEMO CN(C(=O)C[N@H+]1CCCN(c2ccc(C(F)(F)F)cn2)CC1)c1ccccc1 ZINC000012980944 210039094 /nfs/dbraw/zinc/03/90/94/210039094.db2.gz NNXKBJMOOFLQGJ-UHFFFAOYSA-N 1 1 392.425 3.276 10 0 GGAEMO O=C(CSc1ncnc2sccc21)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000012881945 210022657 /nfs/dbraw/zinc/02/26/57/210022657.db2.gz PSXNVTCIBKFBJK-HNNXBMFYSA-N 1 1 384.530 3.174 10 0 GGAEMO Cc1nc2scc(-c3cccs3)c2c(NC2CC[NH+](CC(N)=O)CC2)n1 ZINC000012872147 210020354 /nfs/dbraw/zinc/02/03/54/210020354.db2.gz AKMCADLKCPYWIV-UHFFFAOYSA-N 1 1 387.534 3.090 10 0 GGAEMO CSc1ccc(NC(=O)C[NH+]2CCC(C(=O)NCc3ccccc3)CC2)cc1 ZINC000012797829 210011349 /nfs/dbraw/zinc/01/13/49/210011349.db2.gz IEUWAJUIGKFOLJ-UHFFFAOYSA-N 1 1 397.544 3.375 10 0 GGAEMO CC[C@H]1[C@@H]2OC(=O)[C@H](C)[C@@H]2[C@H]2C[C@@H]([C@@H]3C[C@H](C)C(=O)O3)[N@H+]3CCCC[C@H]1[C@H]23 ZINC000070454824 291126993 /nfs/dbraw/zinc/12/69/93/291126993.db2.gz GYOGHROCTSEKDY-ISVJHBHWSA-N 1 1 375.509 3.015 10 0 biogenic,in-vitro GGAEMO Cc1ccc(NCCCNC(=O)Cc2ccc(Br)cc2O)[nH+]c1 ZINC000477349895 532649759 /nfs/dbraw/zinc/64/97/59/532649759.db2.gz LGKJHLPFVVVOOC-UHFFFAOYSA-N 1 1 378.270 3.019 10 0 GGAEMO O=C(Cc1ccc(Cl)c(Cl)c1)N1CCc2nc[nH]c2[C@@H]1C[NH+]1CCCC1 ZINC000026375892 209242791 /nfs/dbraw/zinc/24/27/91/209242791.db2.gz CJLJXCDVYJKDTR-KRWDZBQOSA-N 1 1 393.318 3.481 10 0 GGAEMO O=C(/C=C\c1ccc(Cl)c(C(F)(F)F)c1)NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000096402092 209240681 /nfs/dbraw/zinc/24/06/81/209240681.db2.gz YBWAXKXVGNZOIE-GNXSNYGWSA-N 1 1 388.817 3.351 10 0 GGAEMO O=C(/C=C\c1ccc2c(c1)OCCO2)NCCC[N@H+]1CCc2ccccc2C1 ZINC000096291433 209240387 /nfs/dbraw/zinc/24/03/87/209240387.db2.gz GJCTUUVJYPBPQJ-CLFYSBASSA-N 1 1 378.472 3.036 10 0 GGAEMO O=C(CNC(=O)[C@H]1CCn2c(c[nH+]c2C2CCCCC2)C1)Nc1cccc(F)c1 ZINC000095993168 209240017 /nfs/dbraw/zinc/24/00/17/209240017.db2.gz YVMFYVNZEIIHOW-INIZCTEOSA-N 1 1 398.482 3.387 10 0 GGAEMO CCCNC(=O)c1ccc(N(C)[C@H](C[N@H+]2CC[C@H](O)C2)c2ccccc2)cc1 ZINC000003828595 209229602 /nfs/dbraw/zinc/22/96/02/209229602.db2.gz FHFHNAQEPILWDK-FCHUYYIVSA-N 1 1 381.520 3.071 10 0 GGAEMO C[N@@H+]1CCN(C(=O)[C@H]2CCCN(C(=O)c3cccs3)C2)[C@@H](c2ccccc2)C1 ZINC000229642061 209188436 /nfs/dbraw/zinc/18/84/36/209188436.db2.gz BHWQICKLGHFLQI-RBUKOAKNSA-N 1 1 397.544 3.116 10 0 GGAEMO C[N@H+]1CCN(C(=O)[C@H]2CCCN(C(=O)c3cccs3)C2)[C@@H](c2ccccc2)C1 ZINC000229642061 209188439 /nfs/dbraw/zinc/18/84/39/209188439.db2.gz BHWQICKLGHFLQI-RBUKOAKNSA-N 1 1 397.544 3.116 10 0 GGAEMO O=C([C@@H]1Cc2ccccc2C[N@H+]1C[C@@H](O)c1ccccc1Cl)N1CCCC1 ZINC000229745203 209188265 /nfs/dbraw/zinc/18/82/65/209188265.db2.gz GPTYWUMJWKPFQO-LEWJYISDSA-N 1 1 384.907 3.423 10 0 GGAEMO O=C([C@@H]1Cc2ccccc2C[N@@H+]1C[C@@H](O)c1ccccc1Cl)N1CCCC1 ZINC000229745203 209188267 /nfs/dbraw/zinc/18/82/67/209188267.db2.gz GPTYWUMJWKPFQO-LEWJYISDSA-N 1 1 384.907 3.423 10 0 GGAEMO C[C@H](C(=O)N1CCCc2ccccc21)[N@@H+]1CCC[C@@H](c2nncn2C2CC2)C1 ZINC000221948460 209187861 /nfs/dbraw/zinc/18/78/61/209187861.db2.gz KDNLCJOITLXRFV-SJLPKXTDSA-N 1 1 379.508 3.160 10 0 GGAEMO C[C@H](C(=O)N1CCCc2ccccc21)[N@H+]1CCC[C@@H](c2nncn2C2CC2)C1 ZINC000221948460 209187865 /nfs/dbraw/zinc/18/78/65/209187865.db2.gz KDNLCJOITLXRFV-SJLPKXTDSA-N 1 1 379.508 3.160 10 0 GGAEMO Cc1cccc2c(C(=O)N3CCC[N@H+]4CCC[C@@H]4C3)cc(-c3cn[nH]c3)nc12 ZINC000023543157 209175685 /nfs/dbraw/zinc/17/56/85/209175685.db2.gz XVWQSKZSRKDPJN-QGZVFWFLSA-N 1 1 375.476 3.244 10 0 GGAEMO O=C(Nc1ccccc1)[C@@H](c1ccccc1)[N@H+]1CCCN(c2cccnn2)CC1 ZINC000106070238 209162465 /nfs/dbraw/zinc/16/24/65/209162465.db2.gz GBMVOIAMQZKDDU-JOCHJYFZSA-N 1 1 387.487 3.369 10 0 GGAEMO O=C(Nc1ccccc1)[C@@H](c1ccccc1)[N@@H+]1CCCN(c2cccnn2)CC1 ZINC000106070238 209162462 /nfs/dbraw/zinc/16/24/62/209162462.db2.gz GBMVOIAMQZKDDU-JOCHJYFZSA-N 1 1 387.487 3.369 10 0 GGAEMO CC[N@H+]1CCC[C@@H](CN(C)C(=O)c2ccncc2Cl)[C@@H]1c1cnn(C)c1 ZINC000328636969 209151473 /nfs/dbraw/zinc/15/14/73/209151473.db2.gz VVJDGEOJMSFSPB-KBXCAEBGSA-N 1 1 375.904 3.014 10 0 GGAEMO CC[N@H+]1CCC[C@@H](CN(C)C(=O)c2ccc(Cl)cn2)[C@@H]1c1cnn(C)c1 ZINC000328633027 209151049 /nfs/dbraw/zinc/15/10/49/209151049.db2.gz SHBKRBZBHZSHGK-KBXCAEBGSA-N 1 1 375.904 3.014 10 0 GGAEMO CN1CC[N@@H+](CCCNC(=O)C2(c3ccc(F)cc3)CC2)[C@@H](c2ccccc2)C1 ZINC000033136108 209138818 /nfs/dbraw/zinc/13/88/18/209138818.db2.gz HAFAWDRLFRNEDK-JOCHJYFZSA-N 1 1 395.522 3.352 10 0 GGAEMO C[N@@H+]1CCN(CCCNC(=O)C2(c3ccc(F)cc3)CC2)[C@@H](c2ccccc2)C1 ZINC000033136108 209138822 /nfs/dbraw/zinc/13/88/22/209138822.db2.gz HAFAWDRLFRNEDK-JOCHJYFZSA-N 1 1 395.522 3.352 10 0 GGAEMO C[N@H+]1CCN(CCCNC(=O)C2(c3ccc(F)cc3)CC2)[C@@H](c2ccccc2)C1 ZINC000033136108 209138826 /nfs/dbraw/zinc/13/88/26/209138826.db2.gz HAFAWDRLFRNEDK-JOCHJYFZSA-N 1 1 395.522 3.352 10 0 GGAEMO O=C(N[C@H]1CCC(=O)N[C@@H]1c1ccccc1)[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000106913171 211443481 /nfs/dbraw/zinc/44/34/81/211443481.db2.gz CGYNULAREIDTIE-FUPPJEDESA-N 1 1 391.515 3.035 10 0 GGAEMO Cc1nn(-c2cccc(Cl)c2)nc1C(=O)NCCC[N@@H+]1CCC[C@H](C)C1 ZINC000097327399 211362856 /nfs/dbraw/zinc/36/28/56/211362856.db2.gz AEYNXTRUAWJLJJ-AWEZNQCLSA-N 1 1 375.904 3.081 10 0 GGAEMO Cc1ccc(NC(=O)[C@@H](c2ccccc2)[NH+]2CCC(C(=O)N(C)C)CC2)cc1 ZINC000096837090 211347217 /nfs/dbraw/zinc/34/72/17/211347217.db2.gz YYBJSHBIJVTCML-OAQYLSRUSA-N 1 1 379.504 3.475 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)CSc1nccnc1Oc1ccccc1 ZINC000096332621 211335193 /nfs/dbraw/zinc/33/51/93/211335193.db2.gz HRRIHLMRDMRSCE-MRXNPFEDSA-N 1 1 386.521 3.352 10 0 GGAEMO CCN(CC)C(=O)[C@@H]1C[C@@H](NC(=O)c2ccsc2)C[N@H+]1C1CCCCC1 ZINC000096163936 211316969 /nfs/dbraw/zinc/31/69/69/211316969.db2.gz XSOOSFFGFKYQAP-AEFFLSMTSA-N 1 1 377.554 3.122 10 0 GGAEMO C[C@H]1CCCC[N@H+]1Cc1cccc(NC(=O)NCc2cnn3cccnc23)c1 ZINC000096148110 211309559 /nfs/dbraw/zinc/30/95/59/211309559.db2.gz NKRWDIMZBOLWSN-INIZCTEOSA-N 1 1 378.480 3.425 10 0 GGAEMO CC[N@H+]1C[C@H]2C3(CC[C@@]2(C(=O)NCC(C)C)C1)CCN(C(=O)CC(C)C)CC3 ZINC000096143873 211308203 /nfs/dbraw/zinc/30/82/03/211308203.db2.gz VOQZKKZVINVCNR-WMZHIEFXSA-N 1 1 391.600 3.145 10 0 GGAEMO CC(C)[C@@H](NC(=O)C[N@H+](C)C(C)C)c1ccccc1NC(=O)CN(C)C(C)C ZINC000095976322 211290650 /nfs/dbraw/zinc/29/06/50/211290650.db2.gz OQDUVTYCJXGWNF-JOCHJYFZSA-N 1 1 390.572 3.119 10 0 GGAEMO CC(C)[C@@H](NC(=O)C[N@@H+](C)C(C)C)c1ccccc1NC(=O)CN(C)C(C)C ZINC000095976322 211290653 /nfs/dbraw/zinc/29/06/53/211290653.db2.gz OQDUVTYCJXGWNF-JOCHJYFZSA-N 1 1 390.572 3.119 10 0 GGAEMO CCOC(=O)C1=C(C[N@H+](C)[C@@H](C)c2ccccc2)NC(=O)N[C@H]1c1ccc(C)o1 ZINC000095948199 211286295 /nfs/dbraw/zinc/28/62/95/211286295.db2.gz DTVHWUXBXPFROG-YWZLYKJASA-N 1 1 397.475 3.452 10 0 GGAEMO CCOC(=O)C1=C(C[N@@H+](C)[C@@H](C)c2ccccc2)NC(=O)N[C@H]1c1ccc(C)o1 ZINC000095948199 211286299 /nfs/dbraw/zinc/28/62/99/211286299.db2.gz DTVHWUXBXPFROG-YWZLYKJASA-N 1 1 397.475 3.452 10 0 GGAEMO CCOC(=O)[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@]12CCOc1c(OC)cccc12 ZINC000095831150 211282578 /nfs/dbraw/zinc/28/25/78/211282578.db2.gz NFONKAWVVRIRND-WMZHIEFXSA-N 1 1 381.472 3.411 10 0 GGAEMO CSc1nn2c(nc(C[N@H+]3CCC[C@@](C)(c4ccccc4)C3)cc2=O)s1 ZINC000095497749 211251640 /nfs/dbraw/zinc/25/16/40/211251640.db2.gz KAPCVZSJFVNWIL-LJQANCHMSA-N 1 1 386.546 3.427 10 0 GGAEMO CC(C)c1ccccc1NC(=O)[C@H](C)N1CC[N@@H+](C2CCN(C)CC2)[C@H](C)C1 ZINC000095456055 211242617 /nfs/dbraw/zinc/24/26/17/211242617.db2.gz KARPIIIHJYUWBH-MOPGFXCFSA-N 1 1 386.584 3.237 10 0 GGAEMO CC(C)c1ccccc1NC(=O)[C@H](C)N1CC[N@H+](C2CCN(C)CC2)[C@H](C)C1 ZINC000095456055 211242622 /nfs/dbraw/zinc/24/26/22/211242622.db2.gz KARPIIIHJYUWBH-MOPGFXCFSA-N 1 1 386.584 3.237 10 0 GGAEMO COc1ccc([C@@H]2C[N@@H+](Cc3ccnc4ccccc34)C[C@H]2NC(C)=O)cc1 ZINC000091586988 211195727 /nfs/dbraw/zinc/19/57/27/211195727.db2.gz FCFXJMFSPYITJO-JTHBVZDNSA-N 1 1 375.472 3.348 10 0 GGAEMO COc1ccccc1-n1cc(C(=O)N(C)Cc2ccc3c(c2)C[N@H+](C)C3)cn1 ZINC000091382183 211190690 /nfs/dbraw/zinc/19/06/90/211190690.db2.gz RVPWBSFVEAGYQP-UHFFFAOYSA-N 1 1 376.460 3.099 10 0 GGAEMO O=C(c1cccc(C[N@H+]2CC[C@H](OCc3ccccn3)C2)c1)N1CCCCC1 ZINC000089883764 211185328 /nfs/dbraw/zinc/18/53/28/211185328.db2.gz DNVQRXHLMFLYAZ-QFIPXVFZSA-N 1 1 379.504 3.499 10 0 GGAEMO CC(C)Oc1ccc2c(c1)n(CC(F)(F)F)nc2NC(=O)N1CC[NH+](C)CC1 ZINC000077387989 211132637 /nfs/dbraw/zinc/13/26/37/211132637.db2.gz GKDNZQSWSOMSMM-UHFFFAOYSA-N 1 1 399.417 3.165 10 0 GGAEMO OCC[C@@H]1C[N@H+](Cc2ccc3ccccc3n2)CCN1Cc1ccccc1F ZINC000077375203 211131588 /nfs/dbraw/zinc/13/15/88/211131588.db2.gz HAYLITJLVGREET-OAQYLSRUSA-N 1 1 379.479 3.443 10 0 GGAEMO OCC[C@@H]1C[N@@H+](Cc2ccc3ccccc3n2)CCN1Cc1ccccc1F ZINC000077375203 211131590 /nfs/dbraw/zinc/13/15/90/211131590.db2.gz HAYLITJLVGREET-OAQYLSRUSA-N 1 1 379.479 3.443 10 0 GGAEMO COc1c(C)cnc(C[N@H+]2CC[C@]3(C2)CCCN(Cc2cccnc2)C3=O)c1C ZINC000072166494 211080899 /nfs/dbraw/zinc/08/08/99/211080899.db2.gz PVSPXAUPPIRNNH-QHCPKHFHSA-N 1 1 394.519 3.117 10 0 GGAEMO COc1c(C)cnc(C[N@H+]2CC[C@@]3(C2)CCCN(Cc2cccnc2)C3=O)c1C ZINC000072166493 211080161 /nfs/dbraw/zinc/08/01/61/211080161.db2.gz PVSPXAUPPIRNNH-HSZRJFAPSA-N 1 1 394.519 3.117 10 0 GGAEMO CCc1nc(C)c([C@H]2C[N@@H+](C)C[C@@H]2C(=O)NCc2oc3ccccc3c2C)[nH]1 ZINC000072125699 211071338 /nfs/dbraw/zinc/07/13/38/211071338.db2.gz ZWBZRJXKWGKCNF-IRXDYDNUSA-N 1 1 380.492 3.297 10 0 GGAEMO CC(C)[C@@H]1CN(C2CCN(C(=O)c3cccnc3)CC2)CCC[N@H+]1CC1CC1 ZINC000071589777 211048622 /nfs/dbraw/zinc/04/86/22/211048622.db2.gz JSOLLLFVIVBXEU-QFIPXVFZSA-N 1 1 384.568 3.129 10 0 GGAEMO COc1ccc(C(=O)N2CC[NH+](Cc3cn(C)c4ccccc34)CC2)c(OC)c1 ZINC000065330069 210988933 /nfs/dbraw/zinc/98/89/33/210988933.db2.gz DVWZKJVDUDDABR-UHFFFAOYSA-N 1 1 393.487 3.154 10 0 GGAEMO COc1cc2c(cc1CCC[NH+](C)C)[C@@H](c1cnc3ccccc3n1)NCC2 ZINC000038805250 210757815 /nfs/dbraw/zinc/75/78/15/210757815.db2.gz FRPQTCSYMUOBCL-QHCPKHFHSA-N 1 1 376.504 3.368 10 0 GGAEMO Cc1c(C(=O)NC2CCCC2)nnn1-c1cccc2c1CC[N@@H+](CC1CC1)C2 ZINC000071890381 210745292 /nfs/dbraw/zinc/74/52/92/210745292.db2.gz ZYATZYGDAZLRMW-UHFFFAOYSA-N 1 1 379.508 3.016 10 0 GGAEMO COc1ccc(C[N@@H+](CC(C)C)C[C@H](O)COCc2ccco2)cc1OC ZINC000036095617 210708926 /nfs/dbraw/zinc/70/89/26/210708926.db2.gz BCMSZVYYFNKDMA-SFHVURJKSA-N 1 1 377.481 3.333 10 0 GGAEMO Cc1ccc(C(=O)N2CCC(CC(=O)NCC[N@@H+]3CCCC[C@H]3C)CC2)cc1 ZINC000032974204 210609652 /nfs/dbraw/zinc/60/96/52/210609652.db2.gz HJLAYXBJGWVOQW-LJQANCHMSA-N 1 1 385.552 3.228 10 0 GGAEMO CCN1CC[NH+](CCCNc2ncnc3onc(-c4ccc(C)cc4)c32)CC1 ZINC000021715106 210390164 /nfs/dbraw/zinc/39/01/64/210390164.db2.gz XQROVHUEUVSKCF-UHFFFAOYSA-N 1 1 380.496 3.033 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CNC(=O)C1CCN(c2ccc(-c3cccs3)nn2)CC1 ZINC000021538830 210385678 /nfs/dbraw/zinc/38/56/78/210385678.db2.gz YXCLDSCUXQZTLX-KRWDZBQOSA-N 1 1 399.564 3.022 10 0 GGAEMO C[C@@H](C(=O)Nc1ccc(F)c(F)c1F)N1CC[NH+](Cc2ccccc2)CC1 ZINC000021822296 210395538 /nfs/dbraw/zinc/39/55/38/210395538.db2.gz QVSDEDPQIYZFRT-AWEZNQCLSA-N 1 1 377.410 3.249 10 0 GGAEMO Cc1ccc2c(c1)c(N1CCCC1=O)c(C(=O)NCC[N@@H+]1CCCC[C@H]1C)n2C ZINC000021529967 210383235 /nfs/dbraw/zinc/38/32/35/210383235.db2.gz DJZZYQJDZWGYHA-QGZVFWFLSA-N 1 1 396.535 3.218 10 0 GGAEMO COc1ccccc1[C@H](CNC(=O)/C=C/c1cnc2ccccc2n1)[NH+](C)C ZINC000021322070 210382190 /nfs/dbraw/zinc/38/21/90/210382190.db2.gz SXNVEDHSBJOCQT-SJFMBGHLSA-N 1 1 376.460 3.071 10 0 GGAEMO Fc1ccccc1-c1noc(NCCC[NH+]2CCN(Cc3ccccc3)CC2)n1 ZINC000020996777 210372715 /nfs/dbraw/zinc/37/27/15/210372715.db2.gz KYVQAMBPYZEYNV-UHFFFAOYSA-N 1 1 395.482 3.496 10 0 GGAEMO O=C(NCCC[NH+]1CCOCC1)c1cc(-c2ccccc2)c(N2CCCC2)s1 ZINC000020985676 210372796 /nfs/dbraw/zinc/37/27/96/210372796.db2.gz POXYOSTUHFYZHK-UHFFFAOYSA-N 1 1 399.560 3.467 10 0 GGAEMO C[NH+]1CCC(N2CCN(Cc3ccc(-c4ccccc4)cc3)C[C@@H]2CCO)CC1 ZINC000020993387 210372430 /nfs/dbraw/zinc/37/24/30/210372430.db2.gz QUNSGWRZDUBGKM-VWLOTQADSA-N 1 1 393.575 3.316 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1cnn(-c2ccc(C)cc2)c1-n1cccc1 ZINC000020933672 210371167 /nfs/dbraw/zinc/37/11/67/210371167.db2.gz QYQXEQJCNFCOBI-LJQANCHMSA-N 1 1 377.492 3.186 10 0 GGAEMO CCN(CC)c1nnc(-n2cccc2C[NH+]2CCN(c3ccccc3)CC2)s1 ZINC000020942812 210370194 /nfs/dbraw/zinc/37/01/94/210370194.db2.gz YWJPHIMUYYDPRB-UHFFFAOYSA-N 1 1 396.564 3.497 10 0 GGAEMO O=C(c1cc(COc2ccccc2)[nH]n1)N1CCC[N@H+](Cc2cccs2)CC1 ZINC000020999866 210375048 /nfs/dbraw/zinc/37/50/48/210375048.db2.gz UOGKWUDMAREUJX-UHFFFAOYSA-N 1 1 396.516 3.398 10 0 GGAEMO O=C(c1cc(COc2ccccc2)[nH]n1)N1CCC[N@@H+](Cc2cccs2)CC1 ZINC000020999866 210375052 /nfs/dbraw/zinc/37/50/52/210375052.db2.gz UOGKWUDMAREUJX-UHFFFAOYSA-N 1 1 396.516 3.398 10 0 GGAEMO O=C(c1cc(COc2ccccc2)n[nH]1)N1CCC[N@H+](Cc2cccs2)CC1 ZINC000020999866 210375055 /nfs/dbraw/zinc/37/50/55/210375055.db2.gz UOGKWUDMAREUJX-UHFFFAOYSA-N 1 1 396.516 3.398 10 0 GGAEMO O=C(c1cc(COc2ccccc2)n[nH]1)N1CCC[N@@H+](Cc2cccs2)CC1 ZINC000020999866 210375059 /nfs/dbraw/zinc/37/50/59/210375059.db2.gz UOGKWUDMAREUJX-UHFFFAOYSA-N 1 1 396.516 3.398 10 0 GGAEMO COc1cccc(-n2cc(-c3ccnc(NCC[C@@H]4CCC[N@H+]4C)n3)cn2)c1 ZINC000020869258 210365475 /nfs/dbraw/zinc/36/54/75/210365475.db2.gz ADYMPTOMRJWSQN-KRWDZBQOSA-N 1 1 378.480 3.234 10 0 GGAEMO CCOC(=O)c1c(C)c(C(=O)N2CC[NH+](Cc3ccccc3)CC2)c(C)n1CC ZINC000020861097 210364239 /nfs/dbraw/zinc/36/42/39/210364239.db2.gz BEPDKTMMVYTHND-UHFFFAOYSA-N 1 1 397.519 3.260 10 0 in-vitro GGAEMO CC[NH+]1CCN([C@@H](c2cccs2)[C@@H](C)NC(=O)Cc2cccs2)CC1 ZINC000020857413 210362664 /nfs/dbraw/zinc/36/26/64/210362664.db2.gz ZNSJQNXKNGIMFP-DNVCBOLYSA-N 1 1 377.579 3.236 10 0 GGAEMO CC[NH+]1CCN([C@H](c2cccs2)[C@H](C)NC(=O)Cc2cccs2)CC1 ZINC000020857419 210362319 /nfs/dbraw/zinc/36/23/19/210362319.db2.gz ZNSJQNXKNGIMFP-KXBFYZLASA-N 1 1 377.579 3.236 10 0 GGAEMO CCCC(=O)N1CCc2c(cnc(C)c2-c2noc([C@@H]3CCCC[N@@H+]3C)n2)C1 ZINC000020780399 210361287 /nfs/dbraw/zinc/36/12/87/210361287.db2.gz GZXKHSZUIAWRSY-KRWDZBQOSA-N 1 1 383.496 3.282 10 0 GGAEMO CCCC(=O)N1CCc2c(cnc(C)c2-c2noc([C@@H]3CCCC[N@H+]3C)n2)C1 ZINC000020780399 210361289 /nfs/dbraw/zinc/36/12/89/210361289.db2.gz GZXKHSZUIAWRSY-KRWDZBQOSA-N 1 1 383.496 3.282 10 0 GGAEMO Cc1ccc(CSCc2ccc(C(=O)NCCC[NH+]3CCOCC3)o2)cc1 ZINC000020723650 210357965 /nfs/dbraw/zinc/35/79/65/210357965.db2.gz WDOJHBOXLBVOAB-UHFFFAOYSA-N 1 1 388.533 3.474 10 0 GGAEMO COc1cc2c(cc1CN[C@H]1CCC[N@H+](C3Cc4ccccc4C3)C1)OCO2 ZINC000020534966 210346569 /nfs/dbraw/zinc/34/65/69/210346569.db2.gz WRMGWHUTUDFWJW-IBGZPJMESA-N 1 1 380.488 3.145 10 0 GGAEMO COc1cc2c(cc1C[NH2+][C@H]1CCCN(C3Cc4ccccc4C3)C1)OCO2 ZINC000020534966 210346573 /nfs/dbraw/zinc/34/65/73/210346573.db2.gz WRMGWHUTUDFWJW-IBGZPJMESA-N 1 1 380.488 3.145 10 0 GGAEMO C[C@H]1CCCC[N@H+]1CCNC(=O)CCCn1c2ccccc2n2cccc2c1=O ZINC000020489807 210340844 /nfs/dbraw/zinc/34/08/44/210340844.db2.gz GRRHXIZOBKOAMY-SFHVURJKSA-N 1 1 394.519 3.025 10 0 GGAEMO CC[NH+]1CCN([C@@H](c2cccs2)[C@@H](C)NC(=O)Cc2ccc(F)cc2)CC1 ZINC000020288157 210327905 /nfs/dbraw/zinc/32/79/05/210327905.db2.gz JXPALQMCANVWGJ-IIBYNOLFSA-N 1 1 389.540 3.313 10 0 GGAEMO CC[NH+]1CCN([C@@H](c2cccs2)[C@H](C)NC(=O)Cc2ccc(F)cc2)CC1 ZINC000020288162 210327708 /nfs/dbraw/zinc/32/77/08/210327708.db2.gz JXPALQMCANVWGJ-HRAATJIYSA-N 1 1 389.540 3.313 10 0 GGAEMO CC[NH+]1CCN([C@H](c2cccs2)[C@H](C)NC(=O)c2cccc(OC)c2)CC1 ZINC000020288063 210327783 /nfs/dbraw/zinc/32/77/83/210327783.db2.gz WSZGCXBKFDTQLL-JXFKEZNVSA-N 1 1 387.549 3.254 10 0 GGAEMO CC[NH+]1CCN([C@@H](c2cccs2)[C@H](C)NC(=O)c2ccc(OC)cc2)CC1 ZINC000020288075 210327338 /nfs/dbraw/zinc/32/73/38/210327338.db2.gz CJJODRLVNMCIAF-OXJNMPFZSA-N 1 1 387.549 3.254 10 0 GGAEMO CC1=C(CC[N@H+]2C[C@H](O)[C@@H](N3CCN(c4ccccn4)CC3)C2)C(C)(C)CCC1 ZINC000019790964 210295256 /nfs/dbraw/zinc/29/52/56/210295256.db2.gz YNXIHYKBPXMDJE-VXKWHMMOSA-N 1 1 398.595 3.165 10 0 GGAEMO O=C(NC1CC1)[C@@H]([NH2+]Cc1ccc(N2CCCCC2=O)cc1)c1ccccc1 ZINC000058217827 136155038 /nfs/dbraw/zinc/15/50/38/136155038.db2.gz BHTHJYMAPSYMND-QFIPXVFZSA-N 1 1 377.488 3.313 10 0 GGAEMO O=C(C1=CC[N@@H+](Cc2cccc(F)c2)CC1)N1CCN(c2ccccc2)CC1 ZINC000064818105 136157872 /nfs/dbraw/zinc/15/78/72/136157872.db2.gz MUTBLRDEDCQSRO-UHFFFAOYSA-N 1 1 379.479 3.307 10 0 GGAEMO CC(C)c1ccccc1OC[C@@H](O)C[NH+]1CCN(c2ccc(Cl)cn2)CC1 ZINC000065490804 136163994 /nfs/dbraw/zinc/16/39/94/136163994.db2.gz PEESSMZSDFUZOF-SFHVURJKSA-N 1 1 389.927 3.420 10 0 GGAEMO CCN1CCN(c2cc(C[NH2+][C@@H](C)c3ccccc3-n3cccn3)ccn2)CC1 ZINC000095407529 136179035 /nfs/dbraw/zinc/17/90/35/136179035.db2.gz JPYOEWODUICNCI-IBGZPJMESA-N 1 1 390.535 3.260 10 0 GGAEMO COc1cccc(N2CC[NH+](Cc3cc(=O)oc4ccc(OC)cc34)CC2)c1 ZINC000096505283 136187360 /nfs/dbraw/zinc/18/73/60/136187360.db2.gz IUJZTMMTJQBTOA-UHFFFAOYSA-N 1 1 380.444 3.132 10 0 GGAEMO CC[NH+]1CCN(c2ccc(C(=O)Nc3ncccc3OC(F)F)cc2F)CC1 ZINC000097000925 136187973 /nfs/dbraw/zinc/18/79/73/136187973.db2.gz KDVPXTHWHKCARI-UHFFFAOYSA-N 1 1 394.397 3.216 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)NC[C@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000252467476 524107009 /nfs/dbraw/zinc/10/70/09/524107009.db2.gz NIXFYENLBYHNMA-IAGOWNOFSA-N 1 1 378.948 3.340 10 0 GGAEMO CC[N@H+]1CCCC[C@H]1CNC(=O)c1c(F)cccc1I ZINC000120030033 564300829 /nfs/dbraw/zinc/30/08/29/564300829.db2.gz QJCUXHIJTBAJGY-NSHDSACASA-N 1 1 390.240 3.035 10 0 GGAEMO C[C@H]([NH2+]Cc1nnc2ccccn21)c1ccc(I)cc1 ZINC000037235825 564420807 /nfs/dbraw/zinc/42/08/07/564420807.db2.gz RASVXNZUQMGLDM-NSHDSACASA-N 1 1 378.217 3.185 10 0 GGAEMO COc1c(Br)cc(Br)cc1C[N@H+](C)[C@H]1CCOC1 ZINC000132116893 564734162 /nfs/dbraw/zinc/73/41/62/564734162.db2.gz NHLSRGKDEOKXSG-NSHDSACASA-N 1 1 379.092 3.441 10 0 GGAEMO COc1c(Br)cc(Br)cc1C[N@@H+](C)[C@H]1CCOC1 ZINC000132116893 564734171 /nfs/dbraw/zinc/73/41/71/564734171.db2.gz NHLSRGKDEOKXSG-NSHDSACASA-N 1 1 379.092 3.441 10 0 GGAEMO C[C@@H]1CC[C@@H](C(N)=O)C[N@@H+]1Cc1cc(Cl)ccc1I ZINC000405047038 565585779 /nfs/dbraw/zinc/58/57/79/565585779.db2.gz SNAFTAJDWKSMFN-NXEZZACHSA-N 1 1 392.668 3.030 10 0 GGAEMO C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1cc(Cl)ccc1I ZINC000405047038 565585782 /nfs/dbraw/zinc/58/57/82/565585782.db2.gz SNAFTAJDWKSMFN-NXEZZACHSA-N 1 1 392.668 3.030 10 0 GGAEMO CC(C)C[N@H+]1CCC[C@@H](O)[C@H](NC(=O)c2ccc(OCc3ccccc3)cc2)C1 ZINC000015671886 560230369 /nfs/dbraw/zinc/23/03/69/560230369.db2.gz BAQWUTIFVPDILP-DHIUTWEWSA-N 1 1 396.531 3.477 10 0 biogenic GGAEMO Cc1ccc(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)cc1I ZINC000115432349 564192910 /nfs/dbraw/zinc/19/29/10/564192910.db2.gz CFSLYTVWLKYXJY-CYBMUJFWSA-N 1 1 386.277 3.013 10 0 GGAEMO CC[N@@H+]1CCO[C@@H](C(=O)Nc2cc(C)n(-c3ccc(Cl)c(Cl)c3)n2)C1 ZINC000538611994 564195535 /nfs/dbraw/zinc/19/55/35/564195535.db2.gz RLLCOAUSAJZIHJ-OAHLLOKOSA-N 1 1 383.279 3.147 10 0 GGAEMO CC[N@H+]1CCO[C@@H](C(=O)Nc2cc(C)n(-c3ccc(Cl)c(Cl)c3)n2)C1 ZINC000538611994 564195540 /nfs/dbraw/zinc/19/55/40/564195540.db2.gz RLLCOAUSAJZIHJ-OAHLLOKOSA-N 1 1 383.279 3.147 10 0 GGAEMO CCOCCC[N@H+]1CC[C@@H](NS(=O)(=O)c2cccc(Cl)c2C)[C@H](C)C1 ZINC000115591900 564196268 /nfs/dbraw/zinc/19/62/68/564196268.db2.gz CXWDQKSIHFSDQX-RHSMWYFYSA-N 1 1 388.961 3.064 10 0 GGAEMO Cn1cc(C[N@@H+]2CCCN(C(=O)Nc3cc(Cl)ccc3Cl)CC2)cn1 ZINC000115633963 564197502 /nfs/dbraw/zinc/19/75/02/564197502.db2.gz MRJVABGCVAPCEU-UHFFFAOYSA-N 1 1 382.295 3.467 10 0 GGAEMO Cn1cc(C[N@H+]2CCCN(C(=O)Nc3cc(Cl)ccc3Cl)CC2)cn1 ZINC000115633963 564197505 /nfs/dbraw/zinc/19/75/05/564197505.db2.gz MRJVABGCVAPCEU-UHFFFAOYSA-N 1 1 382.295 3.467 10 0 GGAEMO C[C@H](Cc1ccc(Br)cc1)NC(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000115803386 564199732 /nfs/dbraw/zinc/19/97/32/564199732.db2.gz NBGWOLLJMXYGEZ-ZBFHGGJFSA-N 1 1 382.346 3.363 10 0 GGAEMO C[C@H]1C[N@H+](C2CCN(C(=O)/C=C/c3csc(Br)c3)CC2)CCO1 ZINC000116196160 564205699 /nfs/dbraw/zinc/20/56/99/564205699.db2.gz OYCKIDAKDFTYPL-IBUXWKBASA-N 1 1 399.354 3.236 10 0 GGAEMO C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC(=O)c1nc(Cl)ccc1Cl ZINC000116248960 564206470 /nfs/dbraw/zinc/20/64/70/564206470.db2.gz HOHKIEURMVTEJJ-DOMZBBRYSA-N 1 1 379.291 3.424 10 0 GGAEMO Cc1[nH]c(=S)sc1CC(=O)N[C@H]1CC[N@H+](Cc2ccccn2)C[C@@H]1C ZINC000116252490 564206649 /nfs/dbraw/zinc/20/66/49/564206649.db2.gz GCXFKUUOWODKHV-WFASDCNBSA-N 1 1 376.551 3.078 10 0 GGAEMO CN(Cc1cc(Cl)cc(Cl)c1)C(=O)C[N@H+]1CC[C@H](c2cnn(C)c2)C1 ZINC000116319373 564207170 /nfs/dbraw/zinc/20/71/70/564207170.db2.gz LAJUAZFIAPMNKG-AWEZNQCLSA-N 1 1 381.307 3.175 10 0 GGAEMO Cn1cc([C@@H]2CC[N@@H+](Cc3nc(-c4cccc(Br)c4)no3)C2)cn1 ZINC000116319815 564207359 /nfs/dbraw/zinc/20/73/59/564207359.db2.gz AEDHAOXJBHDVHA-CYBMUJFWSA-N 1 1 388.269 3.222 10 0 GGAEMO C[C@H](NC(=O)C[N@@H+]1CC[C@H](c2cnn(C)c2)C1)c1ccc(Cl)cc1Cl ZINC000116311528 564207688 /nfs/dbraw/zinc/20/76/88/564207688.db2.gz BAACQNGOCOLXAE-STQMWFEESA-N 1 1 381.307 3.394 10 0 GGAEMO C[C@H](NC(=O)C[N@H+]1CC[C@H](c2cnn(C)c2)C1)c1ccc(Cl)cc1Cl ZINC000116311528 564207691 /nfs/dbraw/zinc/20/76/91/564207691.db2.gz BAACQNGOCOLXAE-STQMWFEESA-N 1 1 381.307 3.394 10 0 GGAEMO COc1ccc(CN2CCN(C[C@@H]3CCCC[N@H+]3C)CC2)cc1Br ZINC000116399953 564209295 /nfs/dbraw/zinc/20/92/95/564209295.db2.gz BETGBAVRTKUDEW-KRWDZBQOSA-N 1 1 396.373 3.060 10 0 GGAEMO Cc1cccc(N2CCC(NC(=O)Cc3cccc(Br)c3)CC2)[nH+]1 ZINC000116667374 564214336 /nfs/dbraw/zinc/21/43/36/564214336.db2.gz UYPQNHDYUZPRPJ-UHFFFAOYSA-N 1 1 388.309 3.480 10 0 GGAEMO CC[N@H+]1CC[C@H](CNC(=O)c2cc(Br)sc2Br)C1 ZINC000116732530 564216044 /nfs/dbraw/zinc/21/60/44/564216044.db2.gz QBLRGESXCXHZTO-MRVPVSSYSA-N 1 1 396.148 3.345 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)c2sccc2Br)C[C@H]1CC ZINC000116772018 564216971 /nfs/dbraw/zinc/21/69/71/564216971.db2.gz YFZDBXANWSMPHG-GFCCVEGCSA-N 1 1 375.332 3.084 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)c2sccc2Br)C[C@H]1CC ZINC000116772018 564216973 /nfs/dbraw/zinc/21/69/73/564216973.db2.gz YFZDBXANWSMPHG-GFCCVEGCSA-N 1 1 375.332 3.084 10 0 GGAEMO CCn1cc(C[N@@H+]2CCCN(Cc3cc(Br)cs3)CC2)cn1 ZINC000116878875 564219032 /nfs/dbraw/zinc/21/90/32/564219032.db2.gz CUXPKNACSKFPAF-UHFFFAOYSA-N 1 1 383.359 3.435 10 0 GGAEMO CCn1cc(C[N@H+]2CCCN(Cc3cc(Br)cs3)CC2)cn1 ZINC000116878875 564219036 /nfs/dbraw/zinc/21/90/36/564219036.db2.gz CUXPKNACSKFPAF-UHFFFAOYSA-N 1 1 383.359 3.435 10 0 GGAEMO Brc1cccc(C[N@@H+]2CCCN(Cc3noc(C4CC4)n3)CC2)c1 ZINC000117106298 564221783 /nfs/dbraw/zinc/22/17/83/564221783.db2.gz CPIWHBADSWNKPR-UHFFFAOYSA-N 1 1 391.313 3.417 10 0 GGAEMO Brc1cccc(C[N@H+]2CCCN(Cc3noc(C4CC4)n3)CC2)c1 ZINC000117106298 564221788 /nfs/dbraw/zinc/22/17/88/564221788.db2.gz CPIWHBADSWNKPR-UHFFFAOYSA-N 1 1 391.313 3.417 10 0 GGAEMO COCC[N@@H+]1CCN(C(=O)CCCc2ccc(Br)s2)C[C@H]1C ZINC000117295862 564225013 /nfs/dbraw/zinc/22/50/13/564225013.db2.gz QHZLRSRMHVJDGI-CYBMUJFWSA-N 1 1 389.359 3.012 10 0 GGAEMO COCC[N@H+]1CCN(C(=O)CCCc2ccc(Br)s2)C[C@H]1C ZINC000117295862 564225014 /nfs/dbraw/zinc/22/50/14/564225014.db2.gz QHZLRSRMHVJDGI-CYBMUJFWSA-N 1 1 389.359 3.012 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)c2cc3c(cccc3Br)[nH]2)C[C@H]1C ZINC000117279455 564225173 /nfs/dbraw/zinc/22/51/73/564225173.db2.gz AEOCIGHLOBOFKT-CYBMUJFWSA-N 1 1 394.313 3.113 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)c2cc3c(cccc3Br)[nH]2)C[C@H]1C ZINC000117279455 564225177 /nfs/dbraw/zinc/22/51/77/564225177.db2.gz AEOCIGHLOBOFKT-CYBMUJFWSA-N 1 1 394.313 3.113 10 0 GGAEMO CC[C@H]1CN(C(=O)c2ccc(C3SCCS3)cc2)CC[N@@H+]1CCOC ZINC000117299844 564225353 /nfs/dbraw/zinc/22/53/53/564225353.db2.gz IHUZEQDLBYVNDP-KRWDZBQOSA-N 1 1 380.579 3.348 10 0 GGAEMO CC[C@H]1CN(C(=O)c2ccc(C3SCCS3)cc2)CC[N@H+]1CCOC ZINC000117299844 564225357 /nfs/dbraw/zinc/22/53/57/564225357.db2.gz IHUZEQDLBYVNDP-KRWDZBQOSA-N 1 1 380.579 3.348 10 0 GGAEMO CC[C@H]1CN(C(=O)c2[nH]c3ccccc3c2Br)CC[N@@H+]1CCOC ZINC000117303438 564225599 /nfs/dbraw/zinc/22/55/99/564225599.db2.gz YHVNOPSAODEWJA-ZDUSSCGKSA-N 1 1 394.313 3.113 10 0 GGAEMO CC[C@H]1CN(C(=O)c2[nH]c3ccccc3c2Br)CC[N@H+]1CCOC ZINC000117303438 564225602 /nfs/dbraw/zinc/22/56/02/564225602.db2.gz YHVNOPSAODEWJA-ZDUSSCGKSA-N 1 1 394.313 3.113 10 0 GGAEMO CC[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2ccc(Br)cc2)CC[N@H+]1CCOC ZINC000117301669 564225725 /nfs/dbraw/zinc/22/57/25/564225725.db2.gz QRQFXXQBTADGGS-KZNAEPCWSA-N 1 1 395.341 3.122 10 0 GGAEMO CC[C@@H]1CN(C(=O)c2cc3cc(Br)ccc3o2)CC[N@@H+]1CCOC ZINC000117309205 564225753 /nfs/dbraw/zinc/22/57/53/564225753.db2.gz MTBWBDRSEFVHOD-OAHLLOKOSA-N 1 1 395.297 3.378 10 0 GGAEMO CC[C@@H]1CN(C(=O)c2cc3cc(Br)ccc3o2)CC[N@H+]1CCOC ZINC000117309205 564225756 /nfs/dbraw/zinc/22/57/56/564225756.db2.gz MTBWBDRSEFVHOD-OAHLLOKOSA-N 1 1 395.297 3.378 10 0 GGAEMO CC[C@H]1CN(C(=O)Nc2ccc(Br)cc2C)CC[N@H+]1CCOC ZINC000117437419 564227175 /nfs/dbraw/zinc/22/71/75/564227175.db2.gz NGZFPJKMBXZVMD-HNNXBMFYSA-N 1 1 384.318 3.332 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)Nc2ccc(Br)cc2F)C[C@H]1C ZINC000117435028 564227190 /nfs/dbraw/zinc/22/71/90/564227190.db2.gz WUMCOBYPBSXLEA-GFCCVEGCSA-N 1 1 388.281 3.163 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)Nc2ccc(Br)cc2F)C[C@H]1C ZINC000117435028 564227195 /nfs/dbraw/zinc/22/71/95/564227195.db2.gz WUMCOBYPBSXLEA-GFCCVEGCSA-N 1 1 388.281 3.163 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)Nc2cccc(Br)c2C)C[C@H]1C ZINC000117453211 564227248 /nfs/dbraw/zinc/22/72/48/564227248.db2.gz CXZNHZRMBXHNPL-CYBMUJFWSA-N 1 1 384.318 3.332 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)Nc2cccc(Br)c2C)C[C@H]1C ZINC000117453211 564227251 /nfs/dbraw/zinc/22/72/51/564227251.db2.gz CXZNHZRMBXHNPL-CYBMUJFWSA-N 1 1 384.318 3.332 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)Nc2cc(Br)ccc2F)C[C@H]1C ZINC000117457500 564227338 /nfs/dbraw/zinc/22/73/38/564227338.db2.gz WVRJOMALAGORNX-GFCCVEGCSA-N 1 1 388.281 3.163 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)Nc2cc(Br)ccc2F)C[C@H]1C ZINC000117457500 564227341 /nfs/dbraw/zinc/22/73/41/564227341.db2.gz WVRJOMALAGORNX-GFCCVEGCSA-N 1 1 388.281 3.163 10 0 GGAEMO COCC[N@@H+]1CCN(C(=O)Nc2ccc(Br)cc2Cl)C[C@@H]1C ZINC000117437253 564227449 /nfs/dbraw/zinc/22/74/49/564227449.db2.gz UFIWIWSBQKMMRF-NSHDSACASA-N 1 1 390.709 3.287 10 0 GGAEMO COCC[N@H+]1CCN(C(=O)Nc2ccc(Br)cc2Cl)C[C@@H]1C ZINC000117437253 564227453 /nfs/dbraw/zinc/22/74/53/564227453.db2.gz UFIWIWSBQKMMRF-NSHDSACASA-N 1 1 390.709 3.287 10 0 GGAEMO CC[C@@H]1CN(C(=O)Nc2cc(Br)ccc2C)CC[N@H+]1CCOC ZINC000117445349 564227718 /nfs/dbraw/zinc/22/77/18/564227718.db2.gz JXILCIHBJQBNDF-OAHLLOKOSA-N 1 1 384.318 3.332 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)Nc2ccc(C)cc2Br)C[C@@H]1C ZINC000117436061 564227812 /nfs/dbraw/zinc/22/78/12/564227812.db2.gz IWOARTDLPAGINX-AWEZNQCLSA-N 1 1 384.318 3.332 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)Nc2ccc(C)cc2Br)C[C@@H]1C ZINC000117436061 564227816 /nfs/dbraw/zinc/22/78/16/564227816.db2.gz IWOARTDLPAGINX-AWEZNQCLSA-N 1 1 384.318 3.332 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)Nc2cc(Br)ccc2F)C[C@@H]1C ZINC000117457496 564227888 /nfs/dbraw/zinc/22/78/88/564227888.db2.gz WVRJOMALAGORNX-LBPRGKRZSA-N 1 1 388.281 3.163 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)Nc2cc(Br)ccc2F)C[C@@H]1C ZINC000117457496 564227890 /nfs/dbraw/zinc/22/78/90/564227890.db2.gz WVRJOMALAGORNX-LBPRGKRZSA-N 1 1 388.281 3.163 10 0 GGAEMO Cc1c[nH+]c(N[C@@H](CO)c2ccsc2)nc1N[C@H](CO)c1ccsc1 ZINC000472646844 564229555 /nfs/dbraw/zinc/22/95/55/564229555.db2.gz CSFCVYJYKNNQLP-CABCVRRESA-N 1 1 376.507 3.199 10 0 GGAEMO O=c1[nH]c(CC[N@@H+]2CCc3cccc(Br)c3C2)nc2ccccc21 ZINC000118411282 564240690 /nfs/dbraw/zinc/24/06/90/564240690.db2.gz VKCGNJUNRMMJNH-UHFFFAOYSA-N 1 1 384.277 3.286 10 0 GGAEMO O=c1[nH]c(CC[N@H+]2CCc3cccc(Br)c3C2)nc2ccccc21 ZINC000118411282 564240695 /nfs/dbraw/zinc/24/06/95/564240695.db2.gz VKCGNJUNRMMJNH-UHFFFAOYSA-N 1 1 384.277 3.286 10 0 GGAEMO Cc1ccc(I)c(C(=O)N2CCC[C@@H]3C[N@@H+](C)CC[C@H]32)c1 ZINC000119253696 564262183 /nfs/dbraw/zinc/26/21/83/564262183.db2.gz FJARZDFSIGWKCV-CZUORRHYSA-N 1 1 398.288 3.156 10 0 GGAEMO CN(CCc1nccs1)C(=O)N[C@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000119375402 564268103 /nfs/dbraw/zinc/26/81/03/564268103.db2.gz LOQIMMFQSDGIKG-RDJZCZTQSA-N 1 1 378.929 3.426 10 0 GGAEMO CN(CCc1nccs1)C(=O)N[C@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000119375402 564268107 /nfs/dbraw/zinc/26/81/07/564268107.db2.gz LOQIMMFQSDGIKG-RDJZCZTQSA-N 1 1 378.929 3.426 10 0 GGAEMO C[NH+](C)C[C@H](NS(=O)(=O)Cc1ccc(Br)cc1)c1ccccc1 ZINC000119432584 564271444 /nfs/dbraw/zinc/27/14/44/564271444.db2.gz OIJUBKSGYZITBT-KRWDZBQOSA-N 1 1 397.338 3.171 10 0 GGAEMO Cc1cccc(C(=O)N2CCC([N@@H+]3CCO[C@@H](C)C3)CC2)c1Br ZINC000119636258 564280139 /nfs/dbraw/zinc/28/01/39/564280139.db2.gz PHSGVZQGJWFROR-AWEZNQCLSA-N 1 1 381.314 3.083 10 0 GGAEMO Cc1cc(C(=O)N2CCC([N@@H+]3CCO[C@@H](C)C3)CC2)ccc1Br ZINC000119636644 564280287 /nfs/dbraw/zinc/28/02/87/564280287.db2.gz AUEWBSXICCAYBF-AWEZNQCLSA-N 1 1 381.314 3.083 10 0 GGAEMO Cn1cc[nH+]c1CC1CCN(S(=O)(=O)c2cccc(Cl)c2Cl)CC1 ZINC000119720451 564284897 /nfs/dbraw/zinc/28/48/97/564284897.db2.gz KYCJTBBEJXSDAM-UHFFFAOYSA-N 1 1 388.320 3.370 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)C(=O)Nc2cc(Cl)ccc2SC)[C@H](C)C1 ZINC000119761784 564287130 /nfs/dbraw/zinc/28/71/30/564287130.db2.gz NPJUJFXFDYDNHC-IUODEOHRSA-N 1 1 383.945 3.189 10 0 GGAEMO Cn1cc[nH+]c1CC1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1 ZINC000119770849 564288060 /nfs/dbraw/zinc/28/80/60/564288060.db2.gz LXJKAGWKQARLRY-UHFFFAOYSA-N 1 1 388.320 3.370 10 0 GGAEMO O=C(CN1CC[NH+](Cc2ccccc2)CC1)Nc1cccc(Br)c1 ZINC000021822162 564312138 /nfs/dbraw/zinc/31/21/38/564312138.db2.gz XHTDVMNKSSOJGS-UHFFFAOYSA-N 1 1 388.309 3.205 10 0 GGAEMO C[N@@H+](Cc1cc(O)ccc1Br)C[C@@H]1CCCN1c1cccnn1 ZINC000120400201 564318773 /nfs/dbraw/zinc/31/87/73/564318773.db2.gz RKAOLDLPIDBGOA-AWEZNQCLSA-N 1 1 377.286 3.046 10 0 GGAEMO C[N@H+](Cc1cc(O)ccc1Br)C[C@@H]1CCCN1c1cccnn1 ZINC000120400201 564318775 /nfs/dbraw/zinc/31/87/75/564318775.db2.gz RKAOLDLPIDBGOA-AWEZNQCLSA-N 1 1 377.286 3.046 10 0 GGAEMO C[C@@H]([NH2+]CC(=O)NCc1ccc2c(c1)OCO2)c1ccccc1Br ZINC000120534094 564324893 /nfs/dbraw/zinc/32/48/93/564324893.db2.gz PVCIJHSESWYFNN-GFCCVEGCSA-N 1 1 391.265 3.145 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)C[C@H](C)c1ccc(Br)cc1 ZINC000120613526 564328888 /nfs/dbraw/zinc/32/88/88/564328888.db2.gz ITHZISLLQZBICB-WMLDXEAASA-N 1 1 383.330 3.170 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)[C@H]1COc2ccc(Br)cc21 ZINC000120742462 564334623 /nfs/dbraw/zinc/33/46/23/564334623.db2.gz UBOSTGZFNKYWDU-HOCLYGCPSA-N 1 1 390.281 3.121 10 0 GGAEMO 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O=C(CN1CCC[N@H+](C2CC2)CC1)Nc1cc(C(F)(F)F)ccc1Cl ZINC000061040943 564704235 /nfs/dbraw/zinc/70/42/35/564704235.db2.gz BBGCFAMOOYWYGN-UHFFFAOYSA-N 1 1 375.822 3.467 10 0 GGAEMO Cc1ccc(C[N@H+](Cc2ccco2)C[C@H]2CCCN(S(C)(=O)=O)C2)s1 ZINC000131191752 564704644 /nfs/dbraw/zinc/70/46/44/564704644.db2.gz PSRCHIWBRYQAFM-MRXNPFEDSA-N 1 1 382.551 3.323 10 0 GGAEMO CCN1CC[NH+](Cc2ccc(NC(=O)c3coc(Br)c3)cc2)CC1 ZINC000061570470 564707181 /nfs/dbraw/zinc/70/71/81/564707181.db2.gz QXAZUKGWZHEOIR-UHFFFAOYSA-N 1 1 392.297 3.432 10 0 GGAEMO CC(C)(C(=O)NCCCC[N@H+]1CCC[C@@H]1CO)c1cccc(Br)c1 ZINC000131487187 564713583 /nfs/dbraw/zinc/71/35/83/564713583.db2.gz CNICTIPWRIQSCF-QGZVFWFLSA-N 1 1 397.357 3.080 10 0 GGAEMO CC(C)(C(=O)NCCCC[N@H+]1CCC[C@H]1CO)c1cccc(Br)c1 ZINC000131487412 564714142 /nfs/dbraw/zinc/71/41/42/564714142.db2.gz CNICTIPWRIQSCF-KRWDZBQOSA-N 1 1 397.357 3.080 10 0 GGAEMO Brc1cc2c(cc1C[N@@H+]1CC[C@@H](Oc3ccncc3)C1)OCO2 ZINC000131871908 564727008 /nfs/dbraw/zinc/72/70/08/564727008.db2.gz DJTXZYVYLXKNCL-CQSZACIVSA-N 1 1 377.238 3.226 10 0 GGAEMO Brc1cc2c(cc1C[N@H+]1CC[C@@H](Oc3ccncc3)C1)OCO2 ZINC000131871908 564727012 /nfs/dbraw/zinc/72/70/12/564727012.db2.gz DJTXZYVYLXKNCL-CQSZACIVSA-N 1 1 377.238 3.226 10 0 GGAEMO CCN(CCc1nccs1)C(=O)[C@H](c1ccccc1)[NH+]1CCSCC1 ZINC000132042847 564731480 /nfs/dbraw/zinc/73/14/80/564731480.db2.gz GSTJMTKSZKXNJI-SFHVURJKSA-N 1 1 375.563 3.324 10 0 GGAEMO Cc1noc(-c2ccc(S(=O)(=O)NCC[NH+]3CCCCCC3)s2)c1C ZINC000065031396 564738324 /nfs/dbraw/zinc/73/83/24/564738324.db2.gz RXWDENUPYTYPOP-UHFFFAOYSA-N 1 1 383.539 3.174 10 0 GGAEMO Cc1c(Br)cccc1C[N@@H+](CC(=O)N1CCCC1)C[C@H]1CCCO1 ZINC000132312133 564739501 /nfs/dbraw/zinc/73/95/01/564739501.db2.gz LATAEIVGCMKGDB-QGZVFWFLSA-N 1 1 395.341 3.361 10 0 GGAEMO Cc1c(Br)cccc1C[N@H+](CC(=O)N1CCCC1)C[C@H]1CCCO1 ZINC000132312133 564739506 /nfs/dbraw/zinc/73/95/06/564739506.db2.gz LATAEIVGCMKGDB-QGZVFWFLSA-N 1 1 395.341 3.361 10 0 GGAEMO Cc1noc([C@@H]2CCC[N@H+](Cc3nc4cc(Br)ccc4[nH]3)C2)n1 ZINC000132625805 564748954 /nfs/dbraw/zinc/74/89/54/564748954.db2.gz DTJAIILGZPIJGR-LLVKDONJSA-N 1 1 376.258 3.396 10 0 GGAEMO Cc1noc([C@@H]2CCC[N@@H+](Cc3nc4cc(Br)ccc4[nH]3)C2)n1 ZINC000132625805 564748956 /nfs/dbraw/zinc/74/89/56/564748956.db2.gz DTJAIILGZPIJGR-LLVKDONJSA-N 1 1 376.258 3.396 10 0 GGAEMO O[C@H](COC[C@@H]1CCCO1)C[N@H+]1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000132859033 564754746 /nfs/dbraw/zinc/75/47/46/564754746.db2.gz CFGGATKKCTZRGK-BPUTZDHNSA-N 1 1 390.307 3.003 10 0 GGAEMO Cc1ccc(CNS(=O)(=O)c2c(F)cccc2Cl)c(N2CCCC2)[nH+]1 ZINC000133356902 564771167 /nfs/dbraw/zinc/77/11/67/564771167.db2.gz ADXLBVZFGJXCDB-UHFFFAOYSA-N 1 1 383.876 3.261 10 0 GGAEMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000133385422 564772103 /nfs/dbraw/zinc/77/21/03/564772103.db2.gz NPBRHRBGULOCBD-IUODEOHRSA-N 1 1 376.298 3.168 10 0 GGAEMO CC(=O)N(c1nc(C[NH2+]CC[C@@H](C)[S@](C)=O)cs1)c1ccc(C)cc1 ZINC000133411520 564773157 /nfs/dbraw/zinc/77/31/57/564773157.db2.gz DXYMTTBKLCEPMG-DLUDVSRJSA-N 1 1 379.551 3.383 10 0 GGAEMO CC(=O)N(c1nc(C[NH2+]CC[C@H](C)[S@@](C)=O)cs1)c1ccc(F)cc1 ZINC000133560436 564777347 /nfs/dbraw/zinc/77/73/47/564777347.db2.gz RTWJKHIKAAYZHF-VDBVYFBLSA-N 1 1 383.514 3.214 10 0 GGAEMO C[C@H](CC(=O)NCCCC[N@H+]1CCC[C@@H]1CO)c1ccc(Br)cc1 ZINC000134022315 564791791 /nfs/dbraw/zinc/79/17/91/564791791.db2.gz OPGRYGWVDKRJQL-CRAIPNDOSA-N 1 1 397.357 3.296 10 0 GGAEMO C[C@@H]([C@@H]1Cc2ccccc2O1)[N@H+](C)CC(=O)Nc1ccc(Br)cn1 ZINC000134253847 564798255 /nfs/dbraw/zinc/79/82/55/564798255.db2.gz IUXCWLAISNXBNA-LRDDRELGSA-N 1 1 390.281 3.107 10 0 GGAEMO C[C@@H]([C@@H]1Cc2ccccc2O1)[N@@H+](C)CC(=O)Nc1ccc(Br)cn1 ZINC000134253847 564798257 /nfs/dbraw/zinc/79/82/57/564798257.db2.gz IUXCWLAISNXBNA-LRDDRELGSA-N 1 1 390.281 3.107 10 0 GGAEMO C[N@@H+](CCNS(=O)(=O)c1sccc1Br)C1CCCCC1 ZINC000068346270 564815549 /nfs/dbraw/zinc/81/55/49/564815549.db2.gz ZJXDNYAPIBHLNG-UHFFFAOYSA-N 1 1 381.361 3.053 10 0 GGAEMO CC[N@H+]1CCC[C@@H](NC(=O)c2[nH]nc(-c3ccccc3)c2Br)C1 ZINC000068461860 564819722 /nfs/dbraw/zinc/81/97/22/564819722.db2.gz GZPHCGMKGLMICM-CYBMUJFWSA-N 1 1 377.286 3.053 10 0 GGAEMO CCOc1cccc(CC[NH2+][C@H](C(N)=O)c2ccc(Br)cc2F)c1 ZINC000135133180 564824389 /nfs/dbraw/zinc/82/43/89/564824389.db2.gz RSRJBCGBIPWIAW-KRWDZBQOSA-N 1 1 395.272 3.346 10 0 GGAEMO C[N@H+]1CC[C@H](CNC(=O)NCc2cscn2)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000135285028 564827043 /nfs/dbraw/zinc/82/70/43/564827043.db2.gz HGTOPAAJZIARNK-WBMJQRKESA-N 1 1 382.892 3.428 10 0 GGAEMO CCCC[N@@H+](CCCc1nc(-c2cccs2)no1)[C@@H]1CCS(=O)(=O)C1 ZINC000071089656 564855205 /nfs/dbraw/zinc/85/52/05/564855205.db2.gz NFPNXIXELFBQDA-CQSZACIVSA-N 1 1 383.539 3.020 10 0 GGAEMO COCCN(CC(F)F)C(=O)NC[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000074538321 564863280 /nfs/dbraw/zinc/86/32/80/564863280.db2.gz SBXIBEAAVVVPSR-XJKSGUPXSA-N 1 1 375.485 3.054 10 0 GGAEMO CC[N@@H+](CCCOc1cccc(I)c1)C[C@H]1CCOC1 ZINC000138359934 564865828 /nfs/dbraw/zinc/86/58/28/564865828.db2.gz GGAYBLCYTXBTCP-CQSZACIVSA-N 1 1 389.277 3.419 10 0 GGAEMO CC[N@@H+](CCCOc1cccc(I)c1)C[C@@H]1CCOC1 ZINC000138359824 564866205 /nfs/dbraw/zinc/86/62/05/564866205.db2.gz GGAYBLCYTXBTCP-AWEZNQCLSA-N 1 1 389.277 3.419 10 0 GGAEMO C[C@H](c1ccccc1Br)[N@H+]1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000139704746 564870237 /nfs/dbraw/zinc/87/02/37/564870237.db2.gz NDADAJDBVKQMPW-CABCVRRESA-N 1 1 381.314 3.081 10 0 GGAEMO C[C@H]1CCC[N@@H+](CCNC(=O)CSCc2cc(-c3cccs3)on2)C1 ZINC000140279287 564871303 /nfs/dbraw/zinc/87/13/03/564871303.db2.gz GLNNJXNZQVOYDR-AWEZNQCLSA-N 1 1 379.551 3.484 10 0 GGAEMO COCCNC(=O)[C@@H]1CC[C@@H](C)[N@@H+](CCOc2c(Cl)cccc2Cl)C1 ZINC000144338566 564877694 /nfs/dbraw/zinc/87/76/94/564877694.db2.gz XXPRJCNMOLEDIU-ZIAGYGMSSA-N 1 1 389.323 3.235 10 0 GGAEMO CCOc1cc(C[N@@H+]2CCC[C@H](C(=O)OC)C2)cc(Br)c1OC ZINC000092643820 564879463 /nfs/dbraw/zinc/87/94/63/564879463.db2.gz WACMFJYFOWJMCZ-ZDUSSCGKSA-N 1 1 386.286 3.241 10 0 GGAEMO CCOc1cc(C[N@H+]2CCC[C@H](C(=O)OC)C2)cc(Br)c1OC ZINC000092643820 564879467 /nfs/dbraw/zinc/87/94/67/564879467.db2.gz WACMFJYFOWJMCZ-ZDUSSCGKSA-N 1 1 386.286 3.241 10 0 GGAEMO CCOc1cc(C[NH+]2CCC(n3cncn3)CC2)cc(Br)c1OC ZINC000092647938 564879573 /nfs/dbraw/zinc/87/95/73/564879573.db2.gz DBOZMLMNNQAGKO-UHFFFAOYSA-N 1 1 395.301 3.285 10 0 GGAEMO CCOCCOc1ccc(Br)cc1C[NH+]1CCC([C@H](C)O)CC1 ZINC000092970542 564883141 /nfs/dbraw/zinc/88/31/41/564883141.db2.gz IBDZPPZGTAJXTN-AWEZNQCLSA-N 1 1 386.330 3.457 10 0 GGAEMO C[C@H]([NH2+]Cc1sccc1Br)c1ccc(S(N)(=O)=O)cc1 ZINC000148030135 564883575 /nfs/dbraw/zinc/88/35/75/564883575.db2.gz DKKKHKBONUVNIA-VIFPVBQESA-N 1 1 375.313 3.009 10 0 GGAEMO COc1sc(C[N@@H+]2CCCC[C@@H]2CN2CCOCC2)cc1Br ZINC000093011241 564884017 /nfs/dbraw/zinc/88/40/17/564884017.db2.gz HCNSOZLSMUYZTH-CYBMUJFWSA-N 1 1 389.359 3.206 10 0 GGAEMO COc1sc(C[N@H+]2CCCC[C@@H]2CN2CCOCC2)cc1Br ZINC000093011241 564884019 /nfs/dbraw/zinc/88/40/19/564884019.db2.gz HCNSOZLSMUYZTH-CYBMUJFWSA-N 1 1 389.359 3.206 10 0 GGAEMO COc1ccc(Br)c(CN2CCN(C[C@@H]3CCCC[N@H+]3C)CC2)c1 ZINC000093147296 564884851 /nfs/dbraw/zinc/88/48/51/564884851.db2.gz PCYPMDBIRJHZRK-KRWDZBQOSA-N 1 1 396.373 3.060 10 0 GGAEMO COc1ccc(Br)c(C[N@@H+]2CCCN(c3ccc(C)nn3)CC2)c1 ZINC000093271778 564885038 /nfs/dbraw/zinc/88/50/38/564885038.db2.gz ATCLVBLPTNSCOM-UHFFFAOYSA-N 1 1 391.313 3.268 10 0 GGAEMO COc1ccc(Br)c(C[N@H+]2CCCN(c3ccc(C)nn3)CC2)c1 ZINC000093271778 564885041 /nfs/dbraw/zinc/88/50/41/564885041.db2.gz ATCLVBLPTNSCOM-UHFFFAOYSA-N 1 1 391.313 3.268 10 0 GGAEMO CCOC(=O)C1(O)CC[NH+](CC2=Cc3cc(Cl)cc(Cl)c3OC2)CC1 ZINC000093595839 564887721 /nfs/dbraw/zinc/88/77/21/564887721.db2.gz HRGBNNZVWOSJOX-UHFFFAOYSA-N 1 1 386.275 3.159 10 0 GGAEMO Cc1nc(C[C@H]2CCC[N@@H+](CCOc3ccccc3Br)C2)no1 ZINC000093789536 564888781 /nfs/dbraw/zinc/88/87/81/564888781.db2.gz OSBUWIKCDKNFOJ-CQSZACIVSA-N 1 1 380.286 3.474 10 0 GGAEMO CCn1cnnc1[C@H]1CCC[N@H+](CCOc2ccccc2Br)C1 ZINC000093788571 564889338 /nfs/dbraw/zinc/88/93/38/564889338.db2.gz ATAAGBQAXFYQEE-AWEZNQCLSA-N 1 1 379.302 3.319 10 0 GGAEMO CCn1cnnc1[C@H]1CCC[N@@H+](CCOc2ccccc2Br)C1 ZINC000093788571 564889341 /nfs/dbraw/zinc/88/93/41/564889341.db2.gz ATAAGBQAXFYQEE-AWEZNQCLSA-N 1 1 379.302 3.319 10 0 GGAEMO C[C@H]1C[N@H+]2CCCC[C@@H]2CN1C(=O)c1csc(I)c1 ZINC000096658525 564903271 /nfs/dbraw/zinc/90/32/71/564903271.db2.gz IFUKBNLXCJNFEE-CMPLNLGQSA-N 1 1 390.290 3.052 10 0 GGAEMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)N[C@H]1CCOc2ccc(Br)cc21 ZINC000097258228 564906625 /nfs/dbraw/zinc/90/66/25/564906625.db2.gz OVUAGIHMIQURGQ-LRDDRELGSA-N 1 1 394.313 3.056 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)CCCOc1ccc(Cl)cc1Cl ZINC000097529363 564908546 /nfs/dbraw/zinc/90/85/46/564908546.db2.gz ABIQBMHPHRBXMQ-OAHLLOKOSA-N 1 1 389.323 3.379 10 0 GGAEMO C[C@@H](O)C[N@@H+]1CCN(C(=O)Nc2ccc(C(F)(F)F)cc2Cl)C[C@@H]1C ZINC000151342982 564915486 /nfs/dbraw/zinc/91/54/86/564915486.db2.gz CVHFHGLRRUAIFC-WDEREUQCSA-N 1 1 379.810 3.278 10 0 GGAEMO C[C@@H](O)C[N@H+]1CCN(C(=O)Nc2ccc(C(F)(F)F)cc2Cl)C[C@@H]1C ZINC000151342982 564915488 /nfs/dbraw/zinc/91/54/88/564915488.db2.gz CVHFHGLRRUAIFC-WDEREUQCSA-N 1 1 379.810 3.278 10 0 GGAEMO CCCC(=O)N[C@H]1CCC[N@@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000101563212 564917632 /nfs/dbraw/zinc/91/76/32/564917632.db2.gz NMGDLKKGEDSELS-GJZGRUSLSA-N 1 1 389.323 3.114 10 0 GGAEMO CCN1CC[NH+](CCC(=O)N[C@H](C)c2c(Cl)ccc(F)c2Cl)CC1 ZINC000101649235 564919649 /nfs/dbraw/zinc/91/96/49/564919649.db2.gz RAFCJUVZEBXYMG-GFCCVEGCSA-N 1 1 376.303 3.337 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)Cc2cc(Cl)cc(Cl)c2)[C@H](C)C1 ZINC000151515406 564924429 /nfs/dbraw/zinc/92/44/29/564924429.db2.gz ZCRJDZAVPAJDJI-MLGOLLRUSA-N 1 1 379.353 3.485 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)Nc1ccc(C)nc1Br ZINC000151552670 564926344 /nfs/dbraw/zinc/92/63/44/564926344.db2.gz AWNNEENZOPQMKT-ZDUSSCGKSA-N 1 1 378.274 3.354 10 0 GGAEMO Cc1oc(-c2ccsc2)nc1C[N@@H+]1CCCC[C@@H]1CCNS(C)(=O)=O ZINC000102655532 564931696 /nfs/dbraw/zinc/93/16/96/564931696.db2.gz YBUGMIONCPAMPY-OAHLLOKOSA-N 1 1 383.539 3.005 10 0 GGAEMO Cc1oc(-c2ccsc2)nc1C[N@H+]1CCCC[C@@H]1CCNS(C)(=O)=O ZINC000102655532 564931698 /nfs/dbraw/zinc/93/16/98/564931698.db2.gz YBUGMIONCPAMPY-OAHLLOKOSA-N 1 1 383.539 3.005 10 0 GGAEMO CC[N@H+]1CC[C@@H](CNC(=O)c2ccc(I)cc2Cl)C1 ZINC000102792423 564936072 /nfs/dbraw/zinc/93/60/72/564936072.db2.gz ZGTBHRUXZANJDA-JTQLQIEISA-N 1 1 392.668 3.016 10 0 GGAEMO COCc1nc2n(n1)CCC[C@@H]2[NH2+][C@@H]1CCc2c1cccc2Br ZINC000151995365 564943206 /nfs/dbraw/zinc/94/32/06/564943206.db2.gz WKPOPAFJSOOFLN-CABCVRRESA-N 1 1 377.286 3.299 10 0 GGAEMO NC(=O)C[C@H]1CCCC[N@H+]1Cc1coc(-c2ccc(Br)cc2)n1 ZINC000103286443 564945887 /nfs/dbraw/zinc/94/58/87/564945887.db2.gz TWOSBBIRZDDXBZ-OAHLLOKOSA-N 1 1 378.270 3.334 10 0 GGAEMO O=C(CCOc1cccc(Cl)c1Cl)NCCCC[N@@H+]1CCC[C@H]1CO ZINC000152136947 564947684 /nfs/dbraw/zinc/94/76/84/564947684.db2.gz SFUOCMFPJKFSKV-AWEZNQCLSA-N 1 1 389.323 3.115 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)NC[C@@H](c1ccco1)[NH+](C)C ZINC000152305988 564954547 /nfs/dbraw/zinc/95/45/47/564954547.db2.gz KZMCOAXHLWIBSM-AWEZNQCLSA-N 1 1 381.270 3.012 10 0 GGAEMO COc1ccccc1CC[N@@H+](C)[C@@H](C(N)=O)c1ccc(Br)cc1 ZINC000104711353 564958267 /nfs/dbraw/zinc/95/82/67/564958267.db2.gz BTMVPZSRXDTKEY-QGZVFWFLSA-N 1 1 377.282 3.159 10 0 GGAEMO O=C(CC[N@H+]1CC[C@@H](Oc2cccnc2)C1)Nc1ccc(Br)cc1 ZINC000152421253 564958985 /nfs/dbraw/zinc/95/89/85/564958985.db2.gz AKPAZYFPWTVAQL-QGZVFWFLSA-N 1 1 390.281 3.326 10 0 GGAEMO C[C@H]1CC[C@H](C(N)=O)C[N@@H+]1Cc1cccc(Br)c1OC(F)F ZINC000152416983 564959133 /nfs/dbraw/zinc/95/91/33/564959133.db2.gz GIQNCYNKQZWSCR-ONGXEEELSA-N 1 1 377.229 3.136 10 0 GGAEMO C[C@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1cccc(Br)c1OC(F)F ZINC000152416983 564959134 /nfs/dbraw/zinc/95/91/34/564959134.db2.gz GIQNCYNKQZWSCR-ONGXEEELSA-N 1 1 377.229 3.136 10 0 GGAEMO COc1cc(Br)c(NC(=O)N2CC[N@H+]3CCCC[C@H]3C2)cc1OC ZINC000105015537 564962809 /nfs/dbraw/zinc/96/28/09/564962809.db2.gz LPGRCBOVXPXHCE-LBPRGKRZSA-N 1 1 398.301 3.168 10 0 GGAEMO C[C@H]([NH2+][C@H](C(N)=O)c1ccc(Br)cc1)c1ccc2c(c1)OCCO2 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GGAEMO Cc1c(Cl)cc(NC(=O)C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1Cl ZINC000266803874 565091399 /nfs/dbraw/zinc/09/13/99/565091399.db2.gz XZCKVULUKIULKL-QXMXGUDHSA-N 1 1 384.307 3.372 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(C(=O)[C@H]2COc3ccc(Br)cc32)CC1 ZINC000369443333 565092491 /nfs/dbraw/zinc/09/24/91/565092491.db2.gz OOMIWGDVPRIJRV-INIZCTEOSA-N 1 1 390.281 3.294 10 0 GGAEMO C[C@H]([NH2+]CC(=O)Nc1ccc(S(C)(=O)=O)cc1)c1ccc(F)cc1Cl ZINC000183794420 565095427 /nfs/dbraw/zinc/09/54/27/565095427.db2.gz CYSHGMZZQAHWIB-NSHDSACASA-N 1 1 384.860 3.172 10 0 GGAEMO C[C@H](NC(=O)C[NH+]1CCC(n2cncn2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000156607994 565098162 /nfs/dbraw/zinc/09/81/62/565098162.db2.gz BRFWMJIYANAGDA-LBPRGKRZSA-N 1 1 382.295 3.099 10 0 GGAEMO CCc1ccccc1NC(=O)C[NH2+][C@H](CO)c1cccc(Br)c1 ZINC000183891715 565101419 /nfs/dbraw/zinc/10/14/19/565101419.db2.gz FBMRYQXLYNMFJQ-QGZVFWFLSA-N 1 1 377.282 3.273 10 0 GGAEMO C[N@H+]1CC[C@]2(CCN(Cc3nnc(-c4ccccc4Br)o3)C2)C1 ZINC000292195641 565103741 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COc1cc(Br)ccc1C[N@@H+](C)C1CCN(c2cnccn2)CC1 ZINC000370041450 565125423 /nfs/dbraw/zinc/12/54/23/565125423.db2.gz QHIICCIYRUHDRI-UHFFFAOYSA-N 1 1 391.313 3.349 10 0 GGAEMO Cc1cc(N2CCN(c3ccnc4cc(Br)cnc43)CC2)nc(C)[nH+]1 ZINC000157291923 565126504 /nfs/dbraw/zinc/12/65/04/565126504.db2.gz XNQAMHCOOZZAIJ-UHFFFAOYSA-N 1 1 399.296 3.126 10 0 GGAEMO COc1cc(NC(=O)c2c[nH+]ccc2N(C)C)cc(OC)c1Br ZINC000184308819 565126896 /nfs/dbraw/zinc/12/68/96/565126896.db2.gz ONSBROJIABTEOX-UHFFFAOYSA-N 1 1 380.242 3.180 10 0 GGAEMO Cc1noc([C@H]2CCC[N@@H+](C[C@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292689001 565129529 /nfs/dbraw/zinc/12/95/29/565129529.db2.gz AHZYSMZYMYNEFF-SJCJKPOMSA-N 1 1 398.276 3.367 10 0 GGAEMO Cc1nn(C)c(CN2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)c1Br ZINC000370148621 565130538 /nfs/dbraw/zinc/13/05/38/565130538.db2.gz BOSUEWMVLGPHHY-AWEZNQCLSA-N 1 1 392.345 3.403 10 0 GGAEMO COCC[N@@H+]1CCN(C(=O)Nc2ccc(Cl)cc2OC(F)F)C[C@@H]1C ZINC000184397176 565133622 /nfs/dbraw/zinc/13/36/22/565133622.db2.gz 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CO[C@@H]1CC[C@H]2OCC[N@@H+](CCC(=O)Nc3cccc(Br)c3)[C@@H]2C1 ZINC000157904414 565148510 /nfs/dbraw/zinc/14/85/10/565148510.db2.gz XDGHEFYRFBJDRY-BRWVUGGUSA-N 1 1 397.313 3.046 10 0 GGAEMO CCOc1cc(C[NH2+][C@@H](C)c2nnc3ccccn32)cc(Br)c1O ZINC000268459198 565153393 /nfs/dbraw/zinc/15/33/93/565153393.db2.gz OTBSUOYUYWOUNI-NSHDSACASA-N 1 1 391.269 3.447 10 0 GGAEMO CC[C@H](O)C[NH+]1CCN(C(=O)N[C@@H](C)c2cc(F)c(Cl)cc2Cl)CC1 ZINC000184714240 565154399 /nfs/dbraw/zinc/15/43/99/565154399.db2.gz HWNUVWXUZFVWNP-RYUDHWBXSA-N 1 1 392.302 3.292 10 0 GGAEMO CC[C@H](O)C[NH+]1CCN(C(=O)N[C@H](C)c2c(Cl)ccc(F)c2Cl)CC1 ZINC000184922030 565166338 /nfs/dbraw/zinc/16/63/38/565166338.db2.gz HHIJICRLZLODEO-NEPJUHHUSA-N 1 1 392.302 3.292 10 0 GGAEMO Cc1cnn([C@H]2CC[N@@H+](C[C@@](C)(O)c3ccc(Br)cc3F)C2)c1 ZINC000293533496 565173354 /nfs/dbraw/zinc/17/33/54/565173354.db2.gz JPHXTEPBZBHEJR-WMLDXEAASA-N 1 1 382.277 3.248 10 0 GGAEMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)Cc2c[nH]c3cccc(Br)c23)C1 ZINC000158581208 565174851 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C[C@@H]1CC[C@](CO)([N@@H+](C)CC(=O)Nc2ccc(OC(F)F)c(Cl)c2)C1 ZINC000188021720 565372051 /nfs/dbraw/zinc/37/20/51/565372051.db2.gz KRICNTFGPKTEAM-DIFFPNOSSA-N 1 1 376.831 3.363 10 0 GGAEMO Fc1cc(Br)ccc1C[NH2+]Cc1cccc(N2CCOCC2)n1 ZINC000274814356 565381531 /nfs/dbraw/zinc/38/15/31/565381531.db2.gz QZYZGQQKDQYECJ-UHFFFAOYSA-N 1 1 380.261 3.110 10 0 GGAEMO O=S1(=O)CCC[C@H](C[N@@H+]2CCC[C@@H]2Cc2ccc(Br)cc2)C1 ZINC000375360436 565383188 /nfs/dbraw/zinc/38/31/88/565383188.db2.gz HWJZGGHJMOCHQV-NVXWUHKLSA-N 1 1 386.355 3.281 10 0 GGAEMO COc1sc(C[NH2+]Cc2cccc(N3CCOCC3)n2)cc1Br ZINC000274825439 565383239 /nfs/dbraw/zinc/38/32/39/565383239.db2.gz SPSSYOHGAJDPNR-UHFFFAOYSA-N 1 1 398.326 3.041 10 0 GGAEMO Cc1cc(C[C@H](C)[NH2+]Cc2ncc(Br)cc2Br)n[nH]1 ZINC000274826033 565383471 /nfs/dbraw/zinc/38/34/71/565383471.db2.gz IEARZJVCVVLATM-QMMMGPOBSA-N 1 1 388.107 3.359 10 0 GGAEMO Cc1cc(Br)cn2c(CN[C@@H](c3nnc[nH]3)c3ccccc3)cnc12 ZINC000375388482 565384250 /nfs/dbraw/zinc/38/42/50/565384250.db2.gz 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/nfs/dbraw/zinc/39/95/51/565399551.db2.gz JLBBZIQGDYBHFG-UHFFFAOYSA-N 1 1 383.359 3.304 10 0 GGAEMO Brc1ccc(-n2cc(C[N@H+]3CCC[C@@H]3Cn3ccnc3)cn2)cc1 ZINC000188402858 565399643 /nfs/dbraw/zinc/39/96/43/565399643.db2.gz MXTYAYCOGXELOR-GOSISDBHSA-N 1 1 386.297 3.496 10 0 GGAEMO Brc1ccc(-n2cc(C[N@H+]3CCC[C@H]3Cn3ccnc3)cn2)cc1 ZINC000188402884 565399793 /nfs/dbraw/zinc/39/97/93/565399793.db2.gz MXTYAYCOGXELOR-SFHVURJKSA-N 1 1 386.297 3.496 10 0 GGAEMO CO[C@@H](C)c1nsc(N2CCC3(C[C@@H]3[N@H+](C)Cc3nccs3)CC2)n1 ZINC000375704654 565401219 /nfs/dbraw/zinc/40/12/19/565401219.db2.gz MWACTCOCKXKLSZ-STQMWFEESA-N 1 1 379.555 3.193 10 0 GGAEMO CO[C@@H](C)c1nsc(N2CCC3(C[C@@H]3[N@@H+](C)Cc3nccs3)CC2)n1 ZINC000375704654 565401222 /nfs/dbraw/zinc/40/12/22/565401222.db2.gz MWACTCOCKXKLSZ-STQMWFEESA-N 1 1 379.555 3.193 10 0 GGAEMO Cc1ccc(N2CCC(NC(=O)Nc3cccc(Br)n3)CC2)[nH+]c1 ZINC000188531524 565407010 /nfs/dbraw/zinc/40/70/10/565407010.db2.gz VIEXLPZHRGIDTP-UHFFFAOYSA-N 1 1 390.285 3.338 10 0 GGAEMO Cc1nc2c(s1)[C@@H](NC(=O)NCC[N@@H+]1CCc3sccc3C1)CCC2 ZINC000375850220 565409408 /nfs/dbraw/zinc/40/94/08/565409408.db2.gz RLCIVNOZKCDGJH-HNNXBMFYSA-N 1 1 376.551 3.248 10 0 GGAEMO Cc1nc2c(s1)[C@@H](NC(=O)NCC[N@H+]1CCc3sccc3C1)CCC2 ZINC000375850220 565409413 /nfs/dbraw/zinc/40/94/13/565409413.db2.gz RLCIVNOZKCDGJH-HNNXBMFYSA-N 1 1 376.551 3.248 10 0 GGAEMO C[C@H]([NH2+]Cc1csc(-c2ccsc2)n1)c1ccc(S(N)(=O)=O)cc1 ZINC000171110501 565410460 /nfs/dbraw/zinc/41/04/60/565410460.db2.gz AVJUTWIFDXQPAG-NSHDSACASA-N 1 1 379.532 3.370 10 0 GGAEMO COc1ccc(Br)cc1NC(=O)NC[C@H]1CCc2[nH+]ccn2C1 ZINC000275441498 565412148 /nfs/dbraw/zinc/41/21/48/565412148.db2.gz FVTULMLVNVAENT-LLVKDONJSA-N 1 1 379.258 3.038 10 0 GGAEMO CCn1nc2c(cc1=O)CN(c1cc[nH+]c3ccc(Br)cc31)CC2 ZINC000375905006 565412581 /nfs/dbraw/zinc/41/25/81/565412581.db2.gz RTONDGMZVHNBDW-UHFFFAOYSA-N 1 1 385.265 3.137 10 0 GGAEMO O=C(CC[N@H+]1CCOC[C@@H]1CC(F)F)Nc1ccccc1Br ZINC000298407068 565413427 /nfs/dbraw/zinc/41/34/27/565413427.db2.gz FJNBQFKVOFNCIK-NSHDSACASA-N 1 1 377.229 3.134 10 0 GGAEMO O=C(CC[N@@H+]1CCOC[C@@H]1CC(F)F)Nc1ccccc1Br ZINC000298407068 565413429 /nfs/dbraw/zinc/41/34/29/565413429.db2.gz FJNBQFKVOFNCIK-NSHDSACASA-N 1 1 377.229 3.134 10 0 GGAEMO C[C@H](CC(=O)N1CC[N@@H+](CC(C)(C)O)[C@H](C)C1)c1ccc(Br)cc1 ZINC000188638538 565413770 /nfs/dbraw/zinc/41/37/70/565413770.db2.gz ZIXHWRMUQVDUOS-HUUCEWRRSA-N 1 1 397.357 3.246 10 0 GGAEMO C[C@H](CC(=O)N1CC[N@@H+](CC(C)(C)O)[C@@H](C)C1)c1ccc(Br)cc1 ZINC000188638563 565414419 /nfs/dbraw/zinc/41/44/19/565414419.db2.gz ZIXHWRMUQVDUOS-CABCVRRESA-N 1 1 397.357 3.246 10 0 GGAEMO C[N@@H+](CCC(=O)Nc1sccc1C(N)=O)[C@H]1CCCC[C@H]1C(F)(F)F ZINC000298440519 565414432 /nfs/dbraw/zinc/41/44/32/565414432.db2.gz QNZVAYLKDJFASY-NEPJUHHUSA-N 1 1 377.432 3.229 10 0 GGAEMO Cn1cc[nH+]c1CC1CCN(C(=O)Nc2cccc(Br)n2)CC1 ZINC000188640410 565414846 /nfs/dbraw/zinc/41/48/46/565414846.db2.gz SBSBAMUYYMIIMM-UHFFFAOYSA-N 1 1 378.274 3.064 10 0 GGAEMO CCN(CC)[C@@H](C)C[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000188693099 565418083 /nfs/dbraw/zinc/41/80/83/565418083.db2.gz NDSIRFSMUQIBCL-HNNXBMFYSA-N 1 1 384.362 3.106 10 0 GGAEMO COC(=O)c1ccc(C[NH2+][C@@H]2CCOc3c(Br)cccc32)nc1 ZINC000298623985 565422995 /nfs/dbraw/zinc/42/29/95/565422995.db2.gz VCPCZCDHUCCAKT-OAHLLOKOSA-N 1 1 377.238 3.244 10 0 GGAEMO COCC[N@H+]1CCCN(C(=O)CCCc2ccc(Br)s2)CC1 ZINC000298597847 565423051 /nfs/dbraw/zinc/42/30/51/565423051.db2.gz RNJFKSWZFWGGIS-UHFFFAOYSA-N 1 1 389.359 3.014 10 0 GGAEMO CC[NH+](CC)[C@H](CNS(=O)(=O)Cc1cccc(OC)c1)c1ccsc1 ZINC000171282063 565423794 /nfs/dbraw/zinc/42/37/94/565423794.db2.gz XOFRWSHWJPGFML-GOSISDBHSA-N 1 1 382.551 3.259 10 0 GGAEMO CCN1CC[C@@H]([N@H+](C)CCC(=O)Nc2ccccc2Br)[C@H](C)C1 ZINC000298720000 565426265 /nfs/dbraw/zinc/42/62/65/565426265.db2.gz UPHFFYXPJHWYCX-RHSMWYFYSA-N 1 1 382.346 3.440 10 0 GGAEMO CCN1CC[C@@H]([N@@H+](C)CCC(=O)Nc2ccccc2Br)[C@H](C)C1 ZINC000298720000 565426269 /nfs/dbraw/zinc/42/62/69/565426269.db2.gz UPHFFYXPJHWYCX-RHSMWYFYSA-N 1 1 382.346 3.440 10 0 GGAEMO COC(=O)[C@H]1CC[N@@H+]([C@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)C1 ZINC000298743630 565427553 /nfs/dbraw/zinc/42/75/53/565427553.db2.gz TYTNCGJWVHVTDW-ZJUUUORDSA-N 1 1 378.778 3.181 10 0 GGAEMO COC(=O)[C@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)C1 ZINC000298743630 565427558 /nfs/dbraw/zinc/42/75/58/565427558.db2.gz TYTNCGJWVHVTDW-ZJUUUORDSA-N 1 1 378.778 3.181 10 0 GGAEMO C[N@@H+](CC(=O)Nc1ccc(Br)cc1Cl)[C@H]1CC[C@H](O)CC1 ZINC000275814289 565427962 /nfs/dbraw/zinc/42/79/62/565427962.db2.gz GONDZCRYCCVTDW-HAQNSBGRSA-N 1 1 375.694 3.276 10 0 GGAEMO CC[N@H+]1CCC[C@@H](NC(=O)N[C@@H](C)c2ccc(Br)cc2OC)C1 ZINC000188893040 565430971 /nfs/dbraw/zinc/43/09/71/565430971.db2.gz ITSPCJSLUGIALD-GXTWGEPZSA-N 1 1 384.318 3.302 10 0 GGAEMO CCn1cnnc1[C@H]1CCC[N@@H+](CCOc2cc(F)cc(Br)c2)C1 ZINC000188927534 565433328 /nfs/dbraw/zinc/43/33/28/565433328.db2.gz NLJPFMRXZQJQDR-ZDUSSCGKSA-N 1 1 397.292 3.458 10 0 GGAEMO CSc1ccccc1NC(=O)CC[N@@H+]1C[C@@H](N2CCCC2)[C@@H](SC)C1 ZINC000299198681 565443997 /nfs/dbraw/zinc/44/39/97/565443997.db2.gz FIVAMXZTWGXGFN-AEFFLSMTSA-N 1 1 379.595 3.249 10 0 GGAEMO CSc1ccccc1NC(=O)CC[N@H+]1C[C@@H](N2CCCC2)[C@@H](SC)C1 ZINC000299198681 565444002 /nfs/dbraw/zinc/44/40/02/565444002.db2.gz FIVAMXZTWGXGFN-AEFFLSMTSA-N 1 1 379.595 3.249 10 0 GGAEMO COc1cc(Br)ccc1[C@H](C)NC(=O)[C@H](C)[NH+]1CCSCC1 ZINC000189138963 565445753 /nfs/dbraw/zinc/44/57/53/565445753.db2.gz DAEDCSFSXVTNHW-RYUDHWBXSA-N 1 1 387.343 3.072 10 0 GGAEMO COc1cc(Br)ccc1[C@@H](C)NC(=O)[C@@H](C)[NH+]1CCSCC1 ZINC000189138937 565445920 /nfs/dbraw/zinc/44/59/20/565445920.db2.gz DAEDCSFSXVTNHW-VXGBXAGGSA-N 1 1 387.343 3.072 10 0 GGAEMO O=C(CCCCOc1ccc(Br)cc1)N1CC[N@H+]2CCC[C@H]2C1 ZINC000171716555 565446620 /nfs/dbraw/zinc/44/66/20/565446620.db2.gz QQTOMVDLKOXNII-INIZCTEOSA-N 1 1 381.314 3.305 10 0 GGAEMO O=C(COc1ccc(C2SCCCS2)cc1)N1CC[NH+](C2CC2)CC1 ZINC000299380125 565448141 /nfs/dbraw/zinc/44/81/41/565448141.db2.gz UOVRZHVFZWNAMV-UHFFFAOYSA-N 1 1 378.563 3.241 10 0 GGAEMO CN(CCCCO)C(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000276438251 565449747 /nfs/dbraw/zinc/44/97/47/565449747.db2.gz KGOXQXJOCZFOCT-UHFFFAOYSA-N 1 1 388.339 3.372 10 0 GGAEMO O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000171776202 565450263 /nfs/dbraw/zinc/45/02/63/565450263.db2.gz OWMMUBFRXMFAQZ-CQSZACIVSA-N 1 1 391.313 3.416 10 0 GGAEMO O=C(c1[nH]nc2ccc(Br)cc21)N1CC[NH+](C2CCCC2)CC1 ZINC000171795703 565450909 /nfs/dbraw/zinc/45/09/09/565450909.db2.gz ZCZNGFXLULAVOS-UHFFFAOYSA-N 1 1 377.286 3.026 10 0 GGAEMO CO[C@@H]1CC[C@@H]2OCC[N@H+](CCOc3cc(F)cc(Br)c3)[C@@H]2C1 ZINC000189274663 565455867 /nfs/dbraw/zinc/45/58/67/565455867.db2.gz RTULIIYQYGUGFW-OIISXLGYSA-N 1 1 388.277 3.235 10 0 GGAEMO CO[C@@H]1CC[C@@H]2OCC[N@@H+](CCOc3cc(F)cc(Br)c3)[C@@H]2C1 ZINC000189274663 565455872 /nfs/dbraw/zinc/45/58/72/565455872.db2.gz RTULIIYQYGUGFW-OIISXLGYSA-N 1 1 388.277 3.235 10 0 GGAEMO CO[C@@H]1CC[C@H]2OCC[N@H+](CCOc3cc(F)cc(Br)c3)[C@@H]2C1 ZINC000189274620 565455924 /nfs/dbraw/zinc/45/59/24/565455924.db2.gz RTULIIYQYGUGFW-DJIMGWMZSA-N 1 1 388.277 3.235 10 0 GGAEMO CO[C@@H]1CC[C@H]2OCC[N@@H+](CCOc3cc(F)cc(Br)c3)[C@@H]2C1 ZINC000189274620 565455927 /nfs/dbraw/zinc/45/59/27/565455927.db2.gz RTULIIYQYGUGFW-DJIMGWMZSA-N 1 1 388.277 3.235 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)Nc1ccc(OC(F)F)c(Cl)c1 ZINC000171908275 565456140 /nfs/dbraw/zinc/45/61/40/565456140.db2.gz YSGXRSWVLCRYHG-LBPRGKRZSA-N 1 1 377.819 3.174 10 0 GGAEMO CC(C)(CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1)c1cccc(Br)c1 ZINC000171906465 565456976 /nfs/dbraw/zinc/45/69/76/565456976.db2.gz BJFOPNYIUPJXQW-MRXNPFEDSA-N 1 1 380.330 3.216 10 0 GGAEMO COc1cc(Br)ccc1CNC(=O)C[N@H+](C)Cc1ccccc1 ZINC000189315861 565458215 /nfs/dbraw/zinc/45/82/15/565458215.db2.gz BDVMALUGFMOSFR-UHFFFAOYSA-N 1 1 377.282 3.206 10 0 GGAEMO COc1cc(Br)ccc1CNC(=O)C[N@@H+](C)Cc1ccccc1 ZINC000189315861 565458221 /nfs/dbraw/zinc/45/82/21/565458221.db2.gz BDVMALUGFMOSFR-UHFFFAOYSA-N 1 1 377.282 3.206 10 0 GGAEMO Cc1c([C@H](C)[NH2+]CC2(C)OCCCO2)nnn1-c1cccc(Br)c1 ZINC000276816264 565462313 /nfs/dbraw/zinc/46/23/13/565462313.db2.gz AFZFHMNCWNIXFD-LBPRGKRZSA-N 1 1 395.301 3.142 10 0 GGAEMO C[C@@H](c1ccc(Br)cc1)N1CC[NH+](C[C@H](O)CC(F)(F)F)CC1 ZINC000189381387 565462821 /nfs/dbraw/zinc/46/28/21/565462821.db2.gz UYKZGIAQIQPKFZ-SWLSCSKDSA-N 1 1 395.263 3.441 10 0 GGAEMO NC(=O)c1coc(C[NH2+]Cc2cc(Br)cc(C(F)(F)F)c2)c1 ZINC000189403343 565463841 /nfs/dbraw/zinc/46/38/41/565463841.db2.gz NCSADZHBKXRAJN-UHFFFAOYSA-N 1 1 377.160 3.450 10 0 GGAEMO Clc1ccc(OCC[NH+]2CCN(c3ncc(Br)cn3)CC2)cc1 ZINC000301118370 565464703 /nfs/dbraw/zinc/46/47/03/565464703.db2.gz RIJYRBUJPQUBHT-UHFFFAOYSA-N 1 1 397.704 3.094 10 0 GGAEMO C[C@H]1OCCC[C@H]1C(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000189442883 565466669 /nfs/dbraw/zinc/46/66/69/565466669.db2.gz LUTQJWBIVJOCSJ-RDTXWAMCSA-N 1 1 395.341 3.345 10 0 GGAEMO Cn1ncc(NC[C@@H]2CCCC[N@H+]2Cc2ccccc2)c(Br)c1=O ZINC000301222775 565473229 /nfs/dbraw/zinc/47/32/29/565473229.db2.gz CSHFXPPOZWMENN-HNNXBMFYSA-N 1 1 391.313 3.009 10 0 GGAEMO CC(C)C[N@H+]1CCO[C@H](CNc2ncnc3ccc(Br)cc32)C1 ZINC000301238285 565474516 /nfs/dbraw/zinc/47/45/16/565474516.db2.gz FCLMQONGGCHPNX-CQSZACIVSA-N 1 1 379.302 3.161 10 0 GGAEMO C[C@H]1C[C@H](N(C)S(=O)(=O)c2cccc(Cl)c2Br)CC[N@H+]1C ZINC000277135216 565477653 /nfs/dbraw/zinc/47/76/53/565477653.db2.gz ZCJWJRXNJHFRLV-WDEREUQCSA-N 1 1 395.750 3.206 10 0 GGAEMO CC[N@H+]1CCC[C@@H](NC(=O)Nc2cc(Br)c(OC)cc2OC)C1 ZINC000189621977 565478627 /nfs/dbraw/zinc/47/86/27/565478627.db2.gz DJKUDDIHFJMQBO-LLVKDONJSA-N 1 1 386.290 3.072 10 0 GGAEMO CN(C)CC[NH+]1CCC(Nc2ccc3cc(Br)ccc3n2)CC1 ZINC000301336091 565479223 /nfs/dbraw/zinc/47/92/23/565479223.db2.gz DBHWDQXMUKXABY-UHFFFAOYSA-N 1 1 377.330 3.435 10 0 GGAEMO Cc1ccc(NC(=O)[C@@H](C)N2CCC[N@H+](C3CC3)CC2)c(Br)c1 ZINC000172346870 565479855 /nfs/dbraw/zinc/47/98/55/565479855.db2.gz DYJGIRCYIPDPPP-CQSZACIVSA-N 1 1 380.330 3.255 10 0 GGAEMO O=C(CN1CCC[N@H+](C2CC2)CC1)Nc1ccc(Br)cc1Cl ZINC000172347274 565480062 /nfs/dbraw/zinc/48/00/62/565480062.db2.gz FJJASSCEYSSGIY-UHFFFAOYSA-N 1 1 386.721 3.211 10 0 GGAEMO CC(C)[N@H+]1CC[C@@H](Nc2ncnc3ccc(I)cc32)C1 ZINC000301366020 565481263 /nfs/dbraw/zinc/48/12/63/565481263.db2.gz NNRSTKWFBUOOEL-GFCCVEGCSA-N 1 1 382.249 3.129 10 0 GGAEMO CSc1nsc(NC(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)n1 ZINC000189716357 565483447 /nfs/dbraw/zinc/48/34/47/565483447.db2.gz FSUAGWRPEURRMH-NEPJUHHUSA-N 1 1 383.930 3.480 10 0 GGAEMO CSc1nsc(NC(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)cc2)n1 ZINC000189716357 565483453 /nfs/dbraw/zinc/48/34/53/565483453.db2.gz FSUAGWRPEURRMH-NEPJUHHUSA-N 1 1 383.930 3.480 10 0 GGAEMO CCC[N@H+]1CCCN(c2cnn(-c3ccc(Cl)cc3)c(=O)c2Cl)CC1 ZINC000301401726 565483584 /nfs/dbraw/zinc/48/35/84/565483584.db2.gz QQUGISFKVYZFLH-UHFFFAOYSA-N 1 1 381.307 3.461 10 0 GGAEMO O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000172413440 565483992 /nfs/dbraw/zinc/48/39/92/565483992.db2.gz JBRWRDVOYGRBFN-CQSZACIVSA-N 1 1 391.313 3.416 10 0 GGAEMO C[N@H+]1CC[C@H](NC(=O)Nc2cccnc2Br)[C@@H]1c1ccccc1 ZINC000189740507 565484476 /nfs/dbraw/zinc/48/44/76/565484476.db2.gz UKIMKWHBIKRURQ-ZFWWWQNUSA-N 1 1 375.270 3.411 10 0 GGAEMO C[NH+](C)[C@@H](CNC(=O)N1CCc2cccc(Br)c2C1)c1ccco1 ZINC000172468123 565487373 /nfs/dbraw/zinc/48/73/73/565487373.db2.gz LATDWVOEDBGOLD-INIZCTEOSA-N 1 1 392.297 3.413 10 0 GGAEMO O[C@@H](C[NH+]1CCN(CCc2ccc(Cl)c(Cl)c2)CC1)CC(F)(F)F ZINC000189793902 565488457 /nfs/dbraw/zinc/48/84/57/565488457.db2.gz KQCPUHXUYZZNMU-CYBMUJFWSA-N 1 1 385.257 3.467 10 0 GGAEMO O[C@@H](COc1cccc(Br)c1)CN1CCC[N@H+](C2CCCC2)CC1 ZINC000172579350 565492557 /nfs/dbraw/zinc/49/25/57/565492557.db2.gz ARSPCDLDIKGUNE-GOSISDBHSA-N 1 1 397.357 3.139 10 0 GGAEMO O[C@H](COc1cccc(Br)c1)CN1CCC[N@H+](C2CCCC2)CC1 ZINC000172579355 565492684 /nfs/dbraw/zinc/49/26/84/565492684.db2.gz ARSPCDLDIKGUNE-SFHVURJKSA-N 1 1 397.357 3.139 10 0 GGAEMO C[C@H]([NH2+][C@@H]1CCN(C)[C@H]1c1ccc(F)cc1)c1ncc(Br)cn1 ZINC000377680519 565493311 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565510100 /nfs/dbraw/zinc/51/01/00/565510100.db2.gz ABDMJPJFBISGSS-HONMWMINSA-N 1 1 382.220 3.118 10 0 GGAEMO O[C@H](C[N@H+]1CCC[C@@H]([C@H](O)C(F)(F)F)C1)c1ccccc1Br ZINC000277617190 565510103 /nfs/dbraw/zinc/51/01/03/565510103.db2.gz ABDMJPJFBISGSS-HONMWMINSA-N 1 1 382.220 3.118 10 0 GGAEMO C[NH+](C)[C@H](CNC(=O)C1(c2ccccc2Br)CC1)c1ccco1 ZINC000190136905 565510418 /nfs/dbraw/zinc/51/04/18/565510418.db2.gz DEYAUAVLNHRTDE-OAHLLOKOSA-N 1 1 377.282 3.493 10 0 GGAEMO O=C(NCc1ccc(Br)c(F)c1)N1CCC(c2cnc[nH]2)CC1 ZINC000378056582 565510465 /nfs/dbraw/zinc/51/04/65/565510465.db2.gz RIPNKHVGKNFPLK-UHFFFAOYSA-N 1 1 381.249 3.401 10 0 GGAEMO CN(CC(C)(C)C[NH+]1CCOCC1)c1ncnc2ccc(Br)cc21 ZINC000301791550 565511160 /nfs/dbraw/zinc/51/11/60/565511160.db2.gz ZQLLTESTRRQLCQ-UHFFFAOYSA-N 1 1 393.329 3.187 10 0 GGAEMO O=C(c1ccccc1I)N1CCC(c2cnc[nH]2)CC1 ZINC000378083155 565511403 /nfs/dbraw/zinc/51/14/03/565511403.db2.gz KAUBYALWRNPYHO-UHFFFAOYSA-N 1 1 381.217 3.034 10 0 GGAEMO C[C@@H](Oc1cccc(Br)c1)C(=O)N1CCC(c2cnc[nH]2)CC1 ZINC000378079605 565511507 /nfs/dbraw/zinc/51/15/07/565511507.db2.gz QZLAPAYXVNPNGA-GFCCVEGCSA-N 1 1 378.270 3.346 10 0 GGAEMO Cc1cccc(C(=O)N2CCC(c3cnc[nH]3)CC2)c1I ZINC000378075683 565511581 /nfs/dbraw/zinc/51/15/81/565511581.db2.gz KSBBVRXOMKQCAI-UHFFFAOYSA-N 1 1 395.244 3.343 10 0 GGAEMO O=C(NCCOCc1ccc(Cl)cc1Cl)N[C@H]1CCc2nc[nH]c2C1 ZINC000378077351 565511665 /nfs/dbraw/zinc/51/16/65/565511665.db2.gz UAYIUYLFODSSDH-ZDUSSCGKSA-N 1 1 383.279 3.090 10 0 GGAEMO CCC[C@@H]1CN(c2ncnc3ccc(Br)cc32)CC[N@H+]1CCOC ZINC000301934883 565519779 /nfs/dbraw/zinc/51/97/79/565519779.db2.gz QOVMWWLFWDMMNA-OAHLLOKOSA-N 1 1 393.329 3.329 10 0 GGAEMO Cn1cc([C@@H](O)C[C@@H]2CCC[N@@H+]2Cc2ccc(Br)c(F)c2)cn1 ZINC000378357149 565524158 /nfs/dbraw/zinc/52/41/58/565524158.db2.gz CALRLMKJISFFLB-YOEHRIQHSA-N 1 1 382.277 3.410 10 0 GGAEMO Cn1cc([C@@H](O)C[C@@H]2CCC[N@H+]2Cc2ccc(Br)c(F)c2)cn1 ZINC000378357149 565524164 /nfs/dbraw/zinc/52/41/64/565524164.db2.gz 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GGAEMO C[C@H]1C[C@@H](N(C)S(=O)(=O)c2c(Cl)cccc2C(F)(F)F)CC[N@H+]1C ZINC000173276670 565543310 /nfs/dbraw/zinc/54/33/10/565543310.db2.gz MFAFDTTVRNEBDF-QWRGUYRKSA-N 1 1 384.851 3.462 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)C(=O)Nc1cc(Cl)c(F)c(Cl)c1 ZINC000190577646 565543599 /nfs/dbraw/zinc/54/35/99/565543599.db2.gz UWYVZCJUISSFJL-LLVKDONJSA-N 1 1 376.259 3.014 10 0 GGAEMO C[N@H+](Cc1cccnc1)C[C@H]1CCN(C(=O)c2coc(Br)c2)C1 ZINC000190587769 565543918 /nfs/dbraw/zinc/54/39/18/565543918.db2.gz CSLUEKDWMMPXIE-CQSZACIVSA-N 1 1 378.270 3.031 10 0 GGAEMO CN1CC[NH+]([C@@H]2CCCCN(C(=O)CSc3ccccc3Cl)C2)CC1 ZINC000173283695 565544313 /nfs/dbraw/zinc/54/43/13/565544313.db2.gz FVBSNDXYLLKLOJ-MRXNPFEDSA-N 1 1 381.973 3.061 10 0 GGAEMO CN1CC[NH+]([C@H]2CCCCN(C(=O)c3cc(F)c(Cl)cc3Cl)C2)CC1 ZINC000173295884 565545728 /nfs/dbraw/zinc/54/57/28/565545728.db2.gz GMFHPKUAOSECFC-ZDUSSCGKSA-N 1 1 388.314 3.375 10 0 GGAEMO C[N@H+](Cc1cccnc1)C[C@H]1CCN(C(=O)c2ccccc2Br)C1 ZINC000190611260 565546178 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CN(C)S(=O)(=O)c1ccc(C[NH2+]Cc2ccsc2Br)cc1 ZINC000388382476 565550956 /nfs/dbraw/zinc/55/09/56/565550956.db2.gz SOGPNDLDWNNZAM-UHFFFAOYSA-N 1 1 389.340 3.051 10 0 GGAEMO CCCCNC(=O)c1ccc(C[NH2+]Cc2c(Br)cnn2C)cc1 ZINC000278306319 565551086 /nfs/dbraw/zinc/55/10/86/565551086.db2.gz DBGPSDGFLZCMCA-UHFFFAOYSA-N 1 1 379.302 3.002 10 0 GGAEMO CC[N@H+]1CC[C@H](NC(=O)c2cc(Br)sc2Br)C1 ZINC000389962977 565555118 /nfs/dbraw/zinc/55/51/18/565555118.db2.gz GEWPZUKGNOJCJE-ZETCQYMHSA-N 1 1 382.121 3.097 10 0 GGAEMO CCOCCOCc1cccc(C[NH2+]Cc2c(Br)cnn2C)c1 ZINC000278387439 565555353 /nfs/dbraw/zinc/55/53/53/565555353.db2.gz MEKKFWAUUIQVEY-UHFFFAOYSA-N 1 1 382.302 3.026 10 0 GGAEMO C[C@@H]1CN(c2ccc(C[NH2+]Cc3ccc(Br)o3)cn2)C[C@H](C)O1 ZINC000190770154 565557355 /nfs/dbraw/zinc/55/73/55/565557355.db2.gz DMBZZRJGCCEMDH-BETUJISGSA-N 1 1 380.286 3.341 10 0 GGAEMO Cn1ncc(Br)c1C[NH2+]Cc1ccc(N2CCCCCC2)nc1 ZINC000278415283 565557949 /nfs/dbraw/zinc/55/79/49/565557949.db2.gz PTMFGIXYGRMRBQ-UHFFFAOYSA-N 1 1 378.318 3.248 10 0 GGAEMO O=C(C1CC[NH+](Cc2ccc(I)cc2)CC1)N1CCCC1 ZINC000173445601 565558432 /nfs/dbraw/zinc/55/84/32/565558432.db2.gz DQYRALRLUOBEHT-UHFFFAOYSA-N 1 1 398.288 3.126 10 0 GGAEMO Cc1nn(Cc2ccccc2)c(C)c1C[NH2+]Cc1c(Br)cnn1C ZINC000278471716 565560876 /nfs/dbraw/zinc/56/08/76/565560876.db2.gz ZOQLKGXHRKNQOK-UHFFFAOYSA-N 1 1 388.313 3.334 10 0 GGAEMO COc1ccc(C[NH2+]Cc2c(Br)cnn2C)c(C(F)(F)F)c1 ZINC000278482010 565560923 /nfs/dbraw/zinc/56/09/23/565560923.db2.gz KURIYZRVUUSOJI-UHFFFAOYSA-N 1 1 378.192 3.500 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)C(=O)C(=O)Nc2cc(Cl)c(F)c(Cl)c2)CC[N@H+]1C ZINC000190836746 565563534 /nfs/dbraw/zinc/56/35/34/565563534.db2.gz HRJNPZIRLMXTKJ-KOLCDFICSA-N 1 1 376.259 3.012 10 0 GGAEMO CCOC(=O)C1CCC(O)(C[N@H+]2CCc3c(Br)cccc3C2)CC1 ZINC000190849182 565564465 /nfs/dbraw/zinc/56/44/65/565564465.db2.gz KZNHEDDONQGIKG-UHFFFAOYSA-N 1 1 396.325 3.292 10 0 GGAEMO CC[N@H+]1CCC[C@@H](NC(=O)CCNc2ncc(C(F)(F)F)cc2Cl)C1 ZINC000173562398 565566797 /nfs/dbraw/zinc/56/67/97/565566797.db2.gz PIPDOAKDVYPAPJ-GFCCVEGCSA-N 1 1 378.826 3.156 10 0 GGAEMO C[C@H]1CCCC[N@H+]1CCNS(=O)(=O)c1cc(Br)ccc1Cl ZINC000303142806 565567657 /nfs/dbraw/zinc/56/76/57/565567657.db2.gz DUEZGZWEYQSKFM-NSHDSACASA-N 1 1 395.750 3.255 10 0 GGAEMO Cn1ncc(Br)c1C[NH2+]C[C@@H](O)c1c(Cl)cccc1Cl ZINC000278591713 565568453 /nfs/dbraw/zinc/56/84/53/565568453.db2.gz ZOIUBCBXVPANJF-GFCCVEGCSA-N 1 1 379.085 3.313 10 0 GGAEMO C[C@@H]1C[NH+](Cc2ccccc2NCc2c(Br)cnn2C)C[C@@H](C)O1 ZINC000278591891 565568471 /nfs/dbraw/zinc/56/84/71/565568471.db2.gz ZRTHEEBMEGNEGN-ZIAGYGMSSA-N 1 1 393.329 3.404 10 0 GGAEMO CC[N@H+]1CCCC[C@@H]1CNC(=O)N1CCN(Cc2ccc(Cl)s2)CC1 ZINC000303425625 565569850 /nfs/dbraw/zinc/56/98/50/565569850.db2.gz AOGKTGBVXMUYQP-OAHLLOKOSA-N 1 1 384.977 3.103 10 0 GGAEMO Cn1nccc1C1CC[NH+](Cc2ccc(I)cc2)CC1 ZINC000173605597 565570505 /nfs/dbraw/zinc/57/05/05/565570505.db2.gz NMEPRRVNMVWDMS-UHFFFAOYSA-N 1 1 381.261 3.404 10 0 GGAEMO COC(=O)[C@@H]1CCC[N@H+](Cc2ncc(-c3cccc(Br)c3)o2)C1 ZINC000173626494 565571982 /nfs/dbraw/zinc/57/19/82/565571982.db2.gz RJRNAZBEGZPJRD-CYBMUJFWSA-N 1 1 379.254 3.489 10 0 GGAEMO COC(=O)[C@@H]1CCC[N@@H+](Cc2ncc(-c3cccc(Br)c3)o2)C1 ZINC000173626494 565571986 /nfs/dbraw/zinc/57/19/86/565571986.db2.gz RJRNAZBEGZPJRD-CYBMUJFWSA-N 1 1 379.254 3.489 10 0 GGAEMO CC[C@@H](Cc1cccc(Br)c1)C(=O)NC[C@@H]1CCC[N@H+]1CCOC ZINC000303679883 565574332 /nfs/dbraw/zinc/57/43/32/565574332.db2.gz MBOSZSXXNSTVQZ-WMZOPIPTSA-N 1 1 397.357 3.245 10 0 GGAEMO C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000173660454 565574416 /nfs/dbraw/zinc/57/44/16/565574416.db2.gz JPAUVNKFKXMLGQ-DGCLKSJQSA-N 1 1 378.270 3.190 10 0 GGAEMO Cc1c(Br)c2ccccc2n1CC(=O)N(C)[C@@H]1CCC[N@@H+](C)C1 ZINC000303906173 565574686 /nfs/dbraw/zinc/57/46/86/565574686.db2.gz LWHCAYZDHDJYCX-CQSZACIVSA-N 1 1 378.314 3.265 10 0 GGAEMO C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1ncc(-c2cccc(Br)c2)o1 ZINC000173660654 565574862 /nfs/dbraw/zinc/57/48/62/565574862.db2.gz WACHWZHZXKQZSM-YPMHNXCESA-N 1 1 378.270 3.190 10 0 GGAEMO COCC[N@@H+]1CCN(Cc2ncc(-c3cccc(Br)c3)o2)C[C@H]1C ZINC000173678541 565575789 /nfs/dbraw/zinc/57/57/89/565575789.db2.gz DCPFJVZYXNVALW-CQSZACIVSA-N 1 1 394.313 3.257 10 0 GGAEMO COCC[N@H+]1CCN(Cc2ncc(-c3cccc(Br)c3)o2)C[C@H]1C ZINC000173678541 565575792 /nfs/dbraw/zinc/57/57/92/565575792.db2.gz DCPFJVZYXNVALW-CQSZACIVSA-N 1 1 394.313 3.257 10 0 GGAEMO Ic1ccc(C[NH+]2CCC(Cn3cccn3)CC2)cc1 ZINC000173694056 565577066 /nfs/dbraw/zinc/57/70/66/565577066.db2.gz QEMSZSPPJLNOOD-UHFFFAOYSA-N 1 1 381.261 3.400 10 0 GGAEMO CC[C@H](NC(=O)N1C[C@H]2CCC[N@H+]2C[C@@H]1C)c1nc(C(F)(F)F)cs1 ZINC000173741779 565581793 /nfs/dbraw/zinc/58/17/93/565581793.db2.gz QJZHPHLGIYZUOX-TUAOUCFPSA-N 1 1 376.448 3.491 10 0 GGAEMO O=C(NC[C@H]1CCC[N@H+]1Cc1ccccc1)c1nscc1Br ZINC000404838203 565583810 /nfs/dbraw/zinc/58/38/10/565583810.db2.gz NRAVQQQVQNRNBF-CYBMUJFWSA-N 1 1 380.311 3.300 10 0 GGAEMO O=C(NC[C@@H]1CCC[N@H+]1Cc1ccccc1)c1nscc1Br ZINC000404838204 565584240 /nfs/dbraw/zinc/58/42/40/565584240.db2.gz NRAVQQQVQNRNBF-ZDUSSCGKSA-N 1 1 380.311 3.300 10 0 GGAEMO C[C@@H]1C[C@H](NC(=O)c2nscc2Br)C[N@H+]1Cc1ccccc1 ZINC000404817792 565584602 /nfs/dbraw/zinc/58/46/02/565584602.db2.gz QSQGLRDVJSCFBY-YPMHNXCESA-N 1 1 380.311 3.298 10 0 GGAEMO O=C(N[C@@H]1CCC[N@@H+](Cc2ccccc2)C1)c1nscc1Br ZINC000404970633 565585650 /nfs/dbraw/zinc/58/56/50/565585650.db2.gz ZMVJYIQEDURIEJ-CYBMUJFWSA-N 1 1 380.311 3.300 10 0 GGAEMO C[C@@H]1C[C@@H](NC(=O)N[C@@H]2CCOc3c(Br)cccc32)C[N@H+]1C1CC1 ZINC000407954840 565588186 /nfs/dbraw/zinc/58/81/86/565588186.db2.gz FNYRGRZATBURLX-XHBSWPGZSA-N 1 1 394.313 3.197 10 0 GGAEMO O=C(c1cc(-c2ccc(Br)cc2)n[nH]1)N1CC[N@@H+]2CCCC[C@H]2C1 ZINC000408023572 565591073 /nfs/dbraw/zinc/59/10/73/565591073.db2.gz UCPFCKFWWNBUGF-HNNXBMFYSA-N 1 1 389.297 3.150 10 0 GGAEMO C[C@H]1CN(C(=O)CCCSc2ccc(Cl)cc2)C[C@@H]1[NH+]1CCOCC1 ZINC000173836375 565592407 /nfs/dbraw/zinc/59/24/07/565592407.db2.gz YEDHKLHKOBFAGV-YJBOKZPZSA-N 1 1 382.957 3.391 10 0 GGAEMO C[C@H]1CN(C(=O)CCCc2ccc(Cl)c(Cl)c2)C[C@H]1[NH+]1CCOCC1 ZINC000173855331 565593491 /nfs/dbraw/zinc/59/34/91/565593491.db2.gz XJWLXPQKIRNRDG-KBXCAEBGSA-N 1 1 385.335 3.495 10 0 GGAEMO O=C(CCc1nc2cc(Br)ccc2s1)N1CC[NH+](C2CC2)CC1 ZINC000173875017 565596041 /nfs/dbraw/zinc/59/60/41/565596041.db2.gz PCINDXKFAPUICG-UHFFFAOYSA-N 1 1 394.338 3.298 10 0 GGAEMO Cc1nn(C)c(C[NH2+]Cc2ccc(N3CCCCC3=O)cc2)c1Br ZINC000279118007 565596592 /nfs/dbraw/zinc/59/65/92/565596592.db2.gz LGXLVQIVNBVDET-UHFFFAOYSA-N 1 1 391.313 3.298 10 0 GGAEMO COc1cc(Cl)c(S(=O)(=O)N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)cc1Cl ZINC000173885134 565597343 /nfs/dbraw/zinc/59/73/43/565597343.db2.gz WYYCTQNKOPAEAC-GWCFXTLKSA-N 1 1 381.325 3.009 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(S(=O)(=O)c2cc(Br)ccc2C)CC1 ZINC000408190758 565597623 /nfs/dbraw/zinc/59/76/23/565597623.db2.gz AKPXWZBDUWXDSW-UHFFFAOYSA-N 1 1 398.326 3.288 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(S(=O)(=O)c2ccc(Br)c(C)c2)CC1 ZINC000408193054 565598171 /nfs/dbraw/zinc/59/81/71/565598171.db2.gz QPWRVMWNXHIGMR-UHFFFAOYSA-N 1 1 398.326 3.288 10 0 GGAEMO O=C(CCC[N@@H+]1CC[C@@](O)(C(F)(F)F)C1)c1ccc(Br)cc1 ZINC000319389751 565599839 /nfs/dbraw/zinc/59/98/39/565599839.db2.gz KTKPDZZOVTZNRY-AWEZNQCLSA-N 1 1 380.204 3.411 10 0 GGAEMO COCC[N@H+]1CCCN(C(=O)c2cc(Cl)c(C)cc2Br)CC1 ZINC000320639886 565603002 /nfs/dbraw/zinc/60/30/02/565603002.db2.gz DNCDUIOOLHVMMB-UHFFFAOYSA-N 1 1 389.721 3.205 10 0 GGAEMO C[N@H+]1Cc2ccc(N[C@H](C(N)=O)c3ccc(Br)cc3F)cc2C1 ZINC000173989949 565605244 /nfs/dbraw/zinc/60/52/44/565605244.db2.gz MCOXEISAXGYROZ-INIZCTEOSA-N 1 1 378.245 3.172 10 0 GGAEMO C[N@H+]1Cc2ccc(N[C@@H](C(N)=O)c3ccc(Br)cc3F)cc2C1 ZINC000173989963 565605680 /nfs/dbraw/zinc/60/56/80/565605680.db2.gz MCOXEISAXGYROZ-MRXNPFEDSA-N 1 1 378.245 3.172 10 0 GGAEMO COc1cc(Br)ccc1[C@@H](C)NC(=O)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000191456853 565605824 /nfs/dbraw/zinc/60/58/24/565605824.db2.gz OKYOLVPNMFWWKX-UKRRQHHQSA-N 1 1 396.329 3.398 10 0 GGAEMO COc1cc(Br)ccc1[C@H](C)NC(=O)N1C[C@H]2CCC[N@H+]2C[C@H]1C ZINC000191467651 565606721 /nfs/dbraw/zinc/60/67/21/565606721.db2.gz WOVXJXWTPKSJLS-VNHYZAJKSA-N 1 1 396.329 3.397 10 0 GGAEMO CCOc1cc(CN2CC[C@H]3[C@@H](CCC[N@H+]3C)C2)cc(Br)c1O ZINC000321827378 565607158 /nfs/dbraw/zinc/60/71/58/565607158.db2.gz BQKYAKRTTIIXMK-HOCLYGCPSA-N 1 1 383.330 3.470 10 0 GGAEMO O=C(C[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O)Nc1ccc(Br)cc1 ZINC000322656194 565610234 /nfs/dbraw/zinc/61/02/34/565610234.db2.gz ZJADWMRICATEQQ-GVDBMIGSSA-N 1 1 381.314 3.403 10 0 GGAEMO C[N@H+](CC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)[C@@]2(C)CC2(Cl)Cl)CC1 ZINC000191582323 565614543 /nfs/dbraw/zinc/61/45/43/565614543.db2.gz SZOFYMMYAREMAC-SUMWQHHRSA-N 1 1 393.355 3.225 10 0 GGAEMO C[N@@H+](CC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)[C@@]2(C)CC2(Cl)Cl)CC1 ZINC000191582323 565614547 /nfs/dbraw/zinc/61/45/47/565614547.db2.gz SZOFYMMYAREMAC-SUMWQHHRSA-N 1 1 393.355 3.225 10 0 GGAEMO C[N@H+](CC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)[C@]2(C)CC2(Cl)Cl)CC1 ZINC000191582336 565614783 /nfs/dbraw/zinc/61/47/83/565614783.db2.gz SZOFYMMYAREMAC-GUYCJALGSA-N 1 1 393.355 3.225 10 0 GGAEMO C[N@@H+](CC(=O)OC(C)(C)C)[C@H]1CCCN(C(=O)[C@]2(C)CC2(Cl)Cl)CC1 ZINC000191582336 565614789 /nfs/dbraw/zinc/61/47/89/565614789.db2.gz SZOFYMMYAREMAC-GUYCJALGSA-N 1 1 393.355 3.225 10 0 GGAEMO C[N@H+](CC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)[C@@]2(C)CC2(Cl)Cl)CC1 ZINC000191582352 565614879 /nfs/dbraw/zinc/61/48/79/565614879.db2.gz SZOFYMMYAREMAC-CXAGYDPISA-N 1 1 393.355 3.225 10 0 GGAEMO C[N@@H+](CC(=O)OC(C)(C)C)[C@@H]1CCCN(C(=O)[C@@]2(C)CC2(Cl)Cl)CC1 ZINC000191582352 565614881 /nfs/dbraw/zinc/61/48/81/565614881.db2.gz SZOFYMMYAREMAC-CXAGYDPISA-N 1 1 393.355 3.225 10 0 GGAEMO COC(=O)C[C@@H]1CCCC[N@@H+]1Cc1nnc(-c2ccccc2Br)o1 ZINC000324431495 565617753 /nfs/dbraw/zinc/61/77/53/565617753.db2.gz BOTHRICGCWVRCL-LBPRGKRZSA-N 1 1 394.269 3.417 10 0 GGAEMO COC(=O)C[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2Br)o1 ZINC000324431495 565617756 /nfs/dbraw/zinc/61/77/56/565617756.db2.gz BOTHRICGCWVRCL-LBPRGKRZSA-N 1 1 394.269 3.417 10 0 GGAEMO C[C@H]1C[C@@H](C(=O)Nc2nccn2Cc2ccc(Br)cc2)CC[N@H+]1C ZINC000279570630 565620362 /nfs/dbraw/zinc/62/03/62/565620362.db2.gz ZJFZUNLXCCKXEB-ZFWWWQNUSA-N 1 1 391.313 3.363 10 0 GGAEMO C[C@H]1C[C@@H](N(C)Cc2ccc(Br)cc2N2CCOCC2)CC[N@H+]1C ZINC000191693944 565621528 /nfs/dbraw/zinc/62/15/28/565621528.db2.gz BMWSIHLWECTPML-YJBOKZPZSA-N 1 1 396.373 3.200 10 0 GGAEMO C[C@H]1C[C@H](N(C)C(=O)Nc2ccccc2I)CC[N@H+]1C ZINC000174234806 565622771 /nfs/dbraw/zinc/62/27/71/565622771.db2.gz RHPKSNWFVUDEQK-NWDGAFQWSA-N 1 1 387.265 3.238 10 0 GGAEMO C[C@@H]1C[C@H](N(C)C(=O)Nc2ccc(I)cc2)CC[N@H+]1C ZINC000174288755 565627425 /nfs/dbraw/zinc/62/74/25/565627425.db2.gz PFOQJZUAVDHQRB-BXUZGUMPSA-N 1 1 387.265 3.238 10 0 GGAEMO CC[C@H](CO)[NH+]1CCN(C(=O)Nc2cccc(Cl)c2Br)CC1 ZINC000191737894 565627720 /nfs/dbraw/zinc/62/77/20/565627720.db2.gz YQDVEKUAKAGXJK-LLVKDONJSA-N 1 1 390.709 3.023 10 0 GGAEMO CN(Cc1nc(C(F)(F)F)cs1)C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000174299002 565628432 /nfs/dbraw/zinc/62/84/32/565628432.db2.gz FBLSEACWHKZPTN-YOGCLGLASA-N 1 1 376.448 3.319 10 0 GGAEMO Cc1csc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c1I ZINC000191764487 565630120 /nfs/dbraw/zinc/63/01/20/565630120.db2.gz PTKARVCXFWIUBD-MNOVXSKESA-N 1 1 392.306 3.216 10 0 GGAEMO C[C@@H]1C[C@H](N(C)C(=O)NCCc2cc(Br)ccc2F)CC[N@H+]1C ZINC000174362825 565630558 /nfs/dbraw/zinc/63/05/58/565630558.db2.gz HAGOJXPLKYSYHE-IUODEOHRSA-N 1 1 386.309 3.255 10 0 GGAEMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)N[C@@H]1CCOc2c(Br)cccc21 ZINC000409706426 565635662 /nfs/dbraw/zinc/63/56/62/565635662.db2.gz KVXSVRLPHNJZFP-OWCLPIDISA-N 1 1 394.313 3.199 10 0 GGAEMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)N[C@@H]1CCOc2c(Br)cccc21 ZINC000409706424 565635828 /nfs/dbraw/zinc/63/58/28/565635828.db2.gz KVXSVRLPHNJZFP-BZUAXINKSA-N 1 1 394.313 3.199 10 0 GGAEMO CCCC[N@@H+](C)CCNC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000409705971 565635910 /nfs/dbraw/zinc/63/59/10/565635910.db2.gz CSZGTWVFBOVSJV-OAHLLOKOSA-N 1 1 384.318 3.304 10 0 GGAEMO CC[C@@H](C)[N@@H+](C)CCNC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000409714286 565636979 /nfs/dbraw/zinc/63/69/79/565636979.db2.gz JZCQASQDOYEPTC-DOMZBBRYSA-N 1 1 384.318 3.302 10 0 GGAEMO COc1ccc(Br)cc1CNC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000174458059 565637000 /nfs/dbraw/zinc/63/70/00/565637000.db2.gz OATREGISFQJPFK-IUODEOHRSA-N 1 1 384.318 3.082 10 0 GGAEMO COc1ccc(Br)cc1CNC(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000174458098 565637870 /nfs/dbraw/zinc/63/78/70/565637870.db2.gz OATREGISFQJPFK-WFASDCNBSA-N 1 1 384.318 3.082 10 0 GGAEMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2cc(C)ccc2I)C1 ZINC000174512926 565640805 /nfs/dbraw/zinc/64/08/05/565640805.db2.gz QQKGIOWNGVJSAM-CYBMUJFWSA-N 1 1 386.277 3.013 10 0 GGAEMO NC(=O)[C@H]([NH2+]CCc1cccc2[nH]ccc21)c1ccc(Br)cc1F ZINC000409845527 565643282 /nfs/dbraw/zinc/64/32/82/565643282.db2.gz WCNQOPBSCQDCCQ-QGZVFWFLSA-N 1 1 390.256 3.428 10 0 GGAEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1ccc(OC)c(Br)c1 ZINC000174572241 565644005 /nfs/dbraw/zinc/64/40/05/565644005.db2.gz HVDOHBSFQHTXJU-HUUCEWRRSA-N 1 1 396.329 3.226 10 0 GGAEMO C[C@@H](CO)[N@H+](Cc1nnc(-c2ccccc2Br)o1)CC1CCC1 ZINC000280311435 565665152 /nfs/dbraw/zinc/66/51/52/565665152.db2.gz GKAAQTZUUIPABQ-LBPRGKRZSA-N 1 1 380.286 3.482 10 0 GGAEMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)N[C@@H]1C[C@H]1c1ccccc1Br ZINC000280418634 565670429 /nfs/dbraw/zinc/67/04/29/565670429.db2.gz AHORFLJXQKNOIE-JWZBEHFJSA-N 1 1 380.330 3.287 10 0 GGAEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1csc(I)c1 ZINC000174982322 565670984 /nfs/dbraw/zinc/67/09/84/565670984.db2.gz QIDQPZCQUNXJDW-VXGBXAGGSA-N 1 1 390.290 3.052 10 0 GGAEMO C[C@]12CCC[N@@H+]1C[C@@H](c1noc(Cc3cc(F)ccc3Br)n1)OC2 ZINC000329597722 565672752 /nfs/dbraw/zinc/67/27/52/565672752.db2.gz PLPGDXFPXNNNGH-WMLDXEAASA-N 1 1 396.260 3.488 10 0 GGAEMO C[C@]12CCC[N@H+]1C[C@@H](c1noc(Cc3cc(F)ccc3Br)n1)OC2 ZINC000329597722 565672758 /nfs/dbraw/zinc/67/27/58/565672758.db2.gz PLPGDXFPXNNNGH-WMLDXEAASA-N 1 1 396.260 3.488 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2c[nH]c3ncc(Br)cc23)[C@H](C)C1 ZINC000280495903 565675091 /nfs/dbraw/zinc/67/50/91/565675091.db2.gz WCBNNDWAPKKMJL-ABAIWWIYSA-N 1 1 379.302 3.128 10 0 GGAEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1CC(=O)Nc1ccc(C)cc1Br ZINC000175044935 565676175 /nfs/dbraw/zinc/67/61/75/565676175.db2.gz PGGCBJLOYMCKSZ-LSDHHAIUSA-N 1 1 380.330 3.255 10 0 GGAEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1CC(=O)Nc1ccc(Br)cc1F ZINC000175031866 565676252 /nfs/dbraw/zinc/67/62/52/565676252.db2.gz FLHGTNPSXYJTAZ-ZIAGYGMSSA-N 1 1 384.293 3.085 10 0 GGAEMO O=C(CSc1n[nH]c(=S)s1)NC[C@H]1CCCC[N@@H+]1Cc1ccccc1 ZINC000175071606 565677559 /nfs/dbraw/zinc/67/75/59/565677559.db2.gz KOVPLLVMAJMGAI-CQSZACIVSA-N 1 1 394.591 3.464 10 0 GGAEMO O=C(CSc1n[nH]c(=S)s1)NC[C@H]1CCCC[N@H+]1Cc1ccccc1 ZINC000175071606 565677562 /nfs/dbraw/zinc/67/75/62/565677562.db2.gz KOVPLLVMAJMGAI-CQSZACIVSA-N 1 1 394.591 3.464 10 0 GGAEMO O[C@]12CCCC[C@@H]1C[N@H+](Cc1cn(-c3ccccc3Br)nn1)CC2 ZINC000329733337 565678114 /nfs/dbraw/zinc/67/81/14/565678114.db2.gz QTUAFFAZEHABOI-KDOFPFPSSA-N 1 1 391.313 3.157 10 0 GGAEMO O[C@]12CCCC[C@@H]1C[N@@H+](Cc1cn(-c3ccccc3Br)nn1)CC2 ZINC000329733337 565678118 /nfs/dbraw/zinc/67/81/18/565678118.db2.gz QTUAFFAZEHABOI-KDOFPFPSSA-N 1 1 391.313 3.157 10 0 GGAEMO COC(=O)c1cccc(NC(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c1Br ZINC000192424478 565689836 /nfs/dbraw/zinc/68/98/36/565689836.db2.gz ZITBVENEWJJSGX-NEPJUHHUSA-N 1 1 398.301 3.182 10 0 GGAEMO O=C(NC1CC([NH+]2CCCCC2)C1)c1n[nH]c2ccc(Br)cc21 ZINC000330060875 565690782 /nfs/dbraw/zinc/69/07/82/565690782.db2.gz NJYOVLHHLUSPIB-UHFFFAOYSA-N 1 1 377.286 3.072 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CN(C)Cc1nc(-c2cccc(Br)c2)no1 ZINC000175345085 565693878 /nfs/dbraw/zinc/69/38/78/565693878.db2.gz AFVICNRSUIIJKY-HNNXBMFYSA-N 1 1 379.302 3.415 10 0 GGAEMO OC[C@@H]([NH2+]C[C@H](O)C(F)(F)F)c1ccc(Br)cc1C(F)(F)F ZINC000280774362 565694851 /nfs/dbraw/zinc/69/48/51/565694851.db2.gz PLLVHSYPPXLABA-ZJUUUORDSA-N 1 1 396.125 3.014 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CN(C)S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000175400658 565697504 /nfs/dbraw/zinc/69/75/04/565697504.db2.gz DPJFPIJZCVXELL-NSHDSACASA-N 1 1 384.851 3.464 10 0 GGAEMO C[N@H+]1CCC[C@H](CNC(=O)NC[C@H](O)c2ccsc2)[C@@H]1c1cccs1 ZINC000175515085 565703981 /nfs/dbraw/zinc/70/39/81/565703981.db2.gz SWQGSYSHJXDRTB-UKPHBRMFSA-N 1 1 379.551 3.225 10 0 GGAEMO CC(C)[NH+]1CCN(CCCN2CCc3cccc(Br)c3C2)CC1 ZINC000192743000 565707839 /nfs/dbraw/zinc/70/78/39/565707839.db2.gz MHPGAHHBKBPNLE-UHFFFAOYSA-N 1 1 380.374 3.223 10 0 GGAEMO C[C@H](NC(=O)N1C[C@H]([NH+]2CCOCC2)[C@@H](C)C1)c1ccc(Cl)c(Cl)c1 ZINC000175623189 565712531 /nfs/dbraw/zinc/71/25/31/565712531.db2.gz HGNWTLZBXSTBFN-DCGLDWPTSA-N 1 1 386.323 3.417 10 0 GGAEMO C[C@H](NC(=O)N1C[C@@H](C)[C@H]([NH+]2CCOCC2)C1)c1ccc(Cl)c(Cl)c1 ZINC000175623210 565712656 /nfs/dbraw/zinc/71/26/56/565712656.db2.gz HGNWTLZBXSTBFN-IIYDPXPESA-N 1 1 386.323 3.417 10 0 GGAEMO C[C@H](NC(=O)N1C[C@H](C)[C@H]([NH+]2CCOCC2)C1)c1ccc(Cl)cc1Cl ZINC000175618557 565712662 /nfs/dbraw/zinc/71/26/62/565712662.db2.gz CLFFDIMMPYSZGP-GDZNZVCISA-N 1 1 386.323 3.417 10 0 GGAEMO C[C@H](NC(=O)N1C[C@H]([NH+]2CCOCC2)[C@@H](C)C1)c1ccc(Cl)cc1Cl ZINC000175618522 565712758 /nfs/dbraw/zinc/71/27/58/565712758.db2.gz CLFFDIMMPYSZGP-DCGLDWPTSA-N 1 1 386.323 3.417 10 0 GGAEMO CCN(CC)C(=O)[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1Br ZINC000411194734 565716524 /nfs/dbraw/zinc/71/65/24/565716524.db2.gz HGOGDZAPTRPFGE-MRXNPFEDSA-N 1 1 396.329 3.111 10 0 GGAEMO CCN(CC)C(=O)[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1Br ZINC000411194732 565716597 /nfs/dbraw/zinc/71/65/97/565716597.db2.gz HGOGDZAPTRPFGE-INIZCTEOSA-N 1 1 396.329 3.111 10 0 GGAEMO Cc1ncsc1C[N@@H+](C)C[C@@H]1CCN(S(=O)(=O)c2ccc(Cl)cc2)C1 ZINC000192932804 565720221 /nfs/dbraw/zinc/72/02/21/565720221.db2.gz KGPBUZOHQSZPSN-AWEZNQCLSA-N 1 1 399.969 3.248 10 0 GGAEMO COCCOCC[N@@H+]1CCC[C@H]1c1ccc(I)cc1 ZINC000175776102 565724077 /nfs/dbraw/zinc/72/40/77/565724077.db2.gz TUYYPMQLAIUNDC-HNNXBMFYSA-N 1 1 375.250 3.091 10 0 GGAEMO COCCOCC[N@H+]1CCC[C@H]1c1ccc(I)cc1 ZINC000175776102 565724080 /nfs/dbraw/zinc/72/40/80/565724080.db2.gz TUYYPMQLAIUNDC-HNNXBMFYSA-N 1 1 375.250 3.091 10 0 GGAEMO CNC(=O)CCOC1CC[NH+](Cc2cccc(Br)c2Cl)CC1 ZINC000411320884 565725465 /nfs/dbraw/zinc/72/54/65/565725465.db2.gz BVSAXLWELCUOQI-UHFFFAOYSA-N 1 1 389.721 3.220 10 0 GGAEMO COC[C@](C)(CCO)[NH2+]Cc1csc(-c2cccc(Br)c2)n1 ZINC000175850990 565728504 /nfs/dbraw/zinc/72/85/04/565728504.db2.gz QUZJQFJNFVLCBD-INIZCTEOSA-N 1 1 385.327 3.450 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)C(=O)C(=O)Nc2ccc(Cl)c(SC)c2)[C@@H](C)C1 ZINC000411425985 565729542 /nfs/dbraw/zinc/72/95/42/565729542.db2.gz RTZITOXJQHOVCA-WFASDCNBSA-N 1 1 383.945 3.189 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)C(=O)C(=O)Nc2ccc(Cl)c(SC)c2)[C@H](C)C1 ZINC000411425974 565730331 /nfs/dbraw/zinc/73/03/31/565730331.db2.gz RTZITOXJQHOVCA-DOMZBBRYSA-N 1 1 383.945 3.189 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)NCc1cc(Br)cs1 ZINC000175877724 565730853 /nfs/dbraw/zinc/73/08/53/565730853.db2.gz KTTOPRNBUSOXPZ-CYBMUJFWSA-N 1 1 383.315 3.390 10 0 GGAEMO CN(C)c1ncc(C[N@@H+](C)CCC(=O)Nc2cc(Cl)ccc2Cl)cn1 ZINC000411491631 565732079 /nfs/dbraw/zinc/73/20/79/565732079.db2.gz BAFOWLDMSMZTDL-UHFFFAOYSA-N 1 1 382.295 3.310 10 0 GGAEMO O=C(C[NH2+][C@H](CO)c1cccc(Br)c1)N1CCC[C@H]2CCCC[C@@H]21 ZINC000411511355 565733453 /nfs/dbraw/zinc/73/34/53/565733453.db2.gz YRQZXEIWWOTAOY-OLMNPRSZSA-N 1 1 395.341 3.253 10 0 GGAEMO O=C(C[NH2+][C@H](CO)c1cccc(Br)c1)N1CCC[C@@H]2CCCC[C@H]21 ZINC000411511354 565733504 /nfs/dbraw/zinc/73/35/04/565733504.db2.gz YRQZXEIWWOTAOY-BMGDILEWSA-N 1 1 395.341 3.253 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)NCc1cc(F)cc(Br)c1 ZINC000175947239 565736097 /nfs/dbraw/zinc/73/60/97/565736097.db2.gz VQYYFPYCDDWSEJ-MRXNPFEDSA-N 1 1 395.276 3.467 10 0 GGAEMO O=C(NCC[NH2+]Cc1c[nH]c(-c2ccccc2)n1)c1cccc(Br)c1 ZINC000175994952 565740274 /nfs/dbraw/zinc/74/02/74/565740274.db2.gz JHNIQMDKVJVYCC-UHFFFAOYSA-N 1 1 399.292 3.359 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)NCc1cccc(Br)c1 ZINC000176029369 565741930 /nfs/dbraw/zinc/74/19/30/565741930.db2.gz UNEFEMMFWJVYRU-INIZCTEOSA-N 1 1 377.286 3.328 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)NCc1cccc(Br)c1 ZINC000176029383 565742581 /nfs/dbraw/zinc/74/25/81/565742581.db2.gz UNEFEMMFWJVYRU-MRXNPFEDSA-N 1 1 377.286 3.328 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)NCc1ccc(Br)c(F)c1 ZINC000176034621 565742717 /nfs/dbraw/zinc/74/27/17/565742717.db2.gz VWSIBWLJGYYCEQ-AWEZNQCLSA-N 1 1 395.276 3.467 10 0 GGAEMO C[N@@H+](CCCO)CCCOc1c(Br)cccc1Br ZINC000411691668 565745406 /nfs/dbraw/zinc/74/54/06/565745406.db2.gz HWOOTJPVZPYDNL-UHFFFAOYSA-N 1 1 381.108 3.295 10 0 GGAEMO C[C@H](C(=O)NC[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)N(C)CC(F)(F)F ZINC000193343154 565745713 /nfs/dbraw/zinc/74/57/13/565745713.db2.gz XPWXTVMAYSDLHP-NFAWXSAZSA-N 1 1 377.476 3.130 10 0 GGAEMO Cn1cc(-c2cc(C[NH2+][C@@H]3CCOc4c(Br)cccc43)on2)cn1 ZINC000281941570 565755988 /nfs/dbraw/zinc/75/59/88/565755988.db2.gz DYWHHZWWFAVSCL-OAHLLOKOSA-N 1 1 389.253 3.451 10 0 GGAEMO CC(C)(C[NH+]1CCCC1)NCCC(=O)Nc1ccc(Br)cc1F ZINC000411866544 565759247 /nfs/dbraw/zinc/75/92/47/565759247.db2.gz HZVAFCHTVDPSID-UHFFFAOYSA-N 1 1 386.309 3.381 10 0 GGAEMO O=C(CC[N@H+]1CCO[C@H](C2CCC2)C1)Nc1ccc(Br)cc1F ZINC000411870327 565759515 /nfs/dbraw/zinc/75/95/15/565759515.db2.gz GEZCSLNREBWBAN-INIZCTEOSA-N 1 1 385.277 3.418 10 0 GGAEMO COC(=O)c1sc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)nc1Cl ZINC000282029274 565761832 /nfs/dbraw/zinc/76/18/32/565761832.db2.gz WLUVIULEJCHBJP-LLVKDONJSA-N 1 1 380.901 3.500 10 0 GGAEMO C[C@@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)N1C[C@@H]2C[N@H+](C)C[C@@H]2C1 ZINC000193612104 565765734 /nfs/dbraw/zinc/76/57/34/565765734.db2.gz XQMNIEZQLOEVQI-SDDRHHMPSA-N 1 1 375.822 3.179 10 0 GGAEMO CCOC[C@@H]1CC[N@@H+](CCCOc2cccc(I)c2)C1 ZINC000176331530 565766131 /nfs/dbraw/zinc/76/61/31/565766131.db2.gz KFZDWENLHLGJNO-CQSZACIVSA-N 1 1 389.277 3.419 10 0 GGAEMO CC(C)[N@H+](CC(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1)C[C@H]1CCC(=O)N1 ZINC000412064402 565768700 /nfs/dbraw/zinc/76/87/00/565768700.db2.gz JXNPTWQPEPXIPI-GXTWGEPZSA-N 1 1 386.323 3.160 10 0 GGAEMO COC(=O)[C@H]1CSCC[N@@H+](Cc2ccc(Br)c3cccnc23)C1 ZINC000412084421 565769024 /nfs/dbraw/zinc/76/90/24/565769024.db2.gz STHCTQIQBHXSSY-CYBMUJFWSA-N 1 1 395.322 3.335 10 0 GGAEMO CC(C)[N@@H+](Cc1nc(-c2ccc(Br)s2)no1)C[C@H]1CCC(=O)N1 ZINC000412090413 565769174 /nfs/dbraw/zinc/76/91/74/565769174.db2.gz ULJZKLHIAUDMAS-SNVBAGLBSA-N 1 1 399.314 3.050 10 0 GGAEMO CC(C)[N@H+](Cc1nc(-c2ccc(Br)s2)no1)C[C@H]1CCC(=O)N1 ZINC000412090413 565769178 /nfs/dbraw/zinc/76/91/78/565769178.db2.gz ULJZKLHIAUDMAS-SNVBAGLBSA-N 1 1 399.314 3.050 10 0 GGAEMO COC(=O)[C@H]1CSCC[N@@H+](CCC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000412080746 565769595 /nfs/dbraw/zinc/76/95/95/565769595.db2.gz QGIBKFZNPPFGDC-LLVKDONJSA-N 1 1 391.320 3.160 10 0 GGAEMO COC(=O)[C@H]1CSCC[N@@H+]([C@H](C)c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000412075189 565769872 /nfs/dbraw/zinc/76/98/72/565769872.db2.gz MGYFSNPAMIQJMM-DGCLKSJQSA-N 1 1 381.885 3.289 10 0 GGAEMO COC(=O)[C@H]1CSCC[N@H+]([C@H](C)c2nc(-c3ccc(Cl)cc3)no2)C1 ZINC000412075189 565769874 /nfs/dbraw/zinc/76/98/74/565769874.db2.gz MGYFSNPAMIQJMM-DGCLKSJQSA-N 1 1 381.885 3.289 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)CSCC(=O)c2ccc(Cl)cc2)[C@H](C)C1 ZINC000176430514 565771719 /nfs/dbraw/zinc/77/17/19/565771719.db2.gz GYZMJNPDEFOWMX-RHSMWYFYSA-N 1 1 382.957 3.445 10 0 GGAEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)CSCC(=O)c1ccc(Cl)cc1 ZINC000176517058 565779645 /nfs/dbraw/zinc/77/96/45/565779645.db2.gz PIOGZNGZDSCQQV-DLBZAZTESA-N 1 1 380.941 3.341 10 0 GGAEMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000282497977 565782537 /nfs/dbraw/zinc/78/25/37/565782537.db2.gz OPFGKTMKQNPZLD-DAXOMENPSA-N 1 1 396.329 3.254 10 0 GGAEMO COCC[NH+]1CCN(C(=O)N[C@@H](C)c2c(Cl)ccc(F)c2Cl)CC1 ZINC000193907508 565782980 /nfs/dbraw/zinc/78/29/80/565782980.db2.gz CYWKPZJSGOXPOQ-NSHDSACASA-N 1 1 378.275 3.167 10 0 GGAEMO Cc1[nH+]ccn1CCCNC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000282535024 565783282 /nfs/dbraw/zinc/78/32/82/565783282.db2.gz MASAPLZWBNZNQV-HNNXBMFYSA-N 1 1 393.285 3.167 10 0 GGAEMO COCCCn1nccc1C[NH2+][C@@H]1CCOc2c(Br)cccc21 ZINC000282524935 565783854 /nfs/dbraw/zinc/78/38/54/565783854.db2.gz ANFZDXFKLQGMIM-MRXNPFEDSA-N 1 1 380.286 3.296 10 0 GGAEMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@H]2CCOc3c(Br)cccc32)C1 ZINC000282539347 565784762 /nfs/dbraw/zinc/78/47/62/565784762.db2.gz SIJHUHIERDFZDM-BBRMVZONSA-N 1 1 396.329 3.256 10 0 GGAEMO C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CCOc3c(Br)cccc32)CC[N@H+]1C ZINC000282570346 565786094 /nfs/dbraw/zinc/78/60/94/565786094.db2.gz VPGQVDZNUXAYKH-IOASZLSFSA-N 1 1 396.329 3.397 10 0 GGAEMO COCc1nc2n(n1)CCC[C@H]2[NH2+][C@H]1CCc2ccc(Br)cc21 ZINC000193990635 565788037 /nfs/dbraw/zinc/78/80/37/565788037.db2.gz IZKWRRUNWSYPMY-LSDHHAIUSA-N 1 1 377.286 3.299 10 0 GGAEMO COCC[N@@H+]1CCN(C(=O)Nc2ccc(Br)c(C)c2F)C[C@@H]1C ZINC000194190504 565799628 /nfs/dbraw/zinc/79/96/28/565799628.db2.gz LKNZDMLPUOPKKG-NSHDSACASA-N 1 1 388.281 3.081 10 0 GGAEMO COCC[N@H+]1CCN(C(=O)Nc2ccc(Br)c(C)c2F)C[C@@H]1C ZINC000194190504 565799633 /nfs/dbraw/zinc/79/96/33/565799633.db2.gz LKNZDMLPUOPKKG-NSHDSACASA-N 1 1 388.281 3.081 10 0 GGAEMO Cc1cccc(NC(=O)[C@H]2CCC[N@H+](Cc3cncc(Br)c3)C2)n1 ZINC000194251161 565803762 /nfs/dbraw/zinc/80/37/62/565803762.db2.gz YOQWHSMLKILMLR-HNNXBMFYSA-N 1 1 389.297 3.398 10 0 GGAEMO Cc1cccc(NC(=O)[C@H]2CCC[N@@H+](Cc3cncc(Br)c3)C2)n1 ZINC000194251161 565803769 /nfs/dbraw/zinc/80/37/69/565803769.db2.gz YOQWHSMLKILMLR-HNNXBMFYSA-N 1 1 389.297 3.398 10 0 GGAEMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)S(=O)(=O)c1c(Cl)cccc1Br ZINC000282936396 565804210 /nfs/dbraw/zinc/80/42/10/565804210.db2.gz IJELOEHSJZOHJP-MFKMUULPSA-N 1 1 395.750 3.063 10 0 GGAEMO CCc1cc(=O)[nH]c(C[NH2+]C2(c3ccc(Br)cc3)CCOCC2)n1 ZINC000176819478 565806529 /nfs/dbraw/zinc/80/65/29/565806529.db2.gz TZWUTOVQRLPHOC-UHFFFAOYSA-N 1 1 392.297 3.303 10 0 GGAEMO O=C(C[N@@H+]1CCCN(CCc2cc(Cl)cc(Cl)c2)CC1)N1CCCC1 ZINC000194415687 565814218 /nfs/dbraw/zinc/81/42/18/565814218.db2.gz FAXUBQHLVIRLNA-UHFFFAOYSA-N 1 1 384.351 3.166 10 0 GGAEMO O=C(Cc1csc(Cc2cccc(Cl)c2)n1)N1CC[NH+](C2CC2)CC1 ZINC000194450103 565815910 /nfs/dbraw/zinc/81/59/10/565815910.db2.gz LNAQSPZAINVIKO-UHFFFAOYSA-N 1 1 375.925 3.236 10 0 GGAEMO Cc1cc(NC(=O)[C@@H](C)[NH2+][C@@H]2CCOc3c(Br)cccc32)on1 ZINC000283422089 565818727 /nfs/dbraw/zinc/81/87/27/565818727.db2.gz GRFASFCTQDYWKY-ZWNOBZJWSA-N 1 1 380.242 3.186 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)[C@@H](C)NC(=O)c1cccc(Cl)c1Cl ZINC000176980040 565819347 /nfs/dbraw/zinc/81/93/47/565819347.db2.gz CMUAQFAHTHDDQV-CHWSQXEVSA-N 1 1 386.323 3.054 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)CSc1ncnc2sc(C)c(C)c21 ZINC000176995261 565821827 /nfs/dbraw/zinc/82/18/27/565821827.db2.gz LMLLUVIPEVHQQP-AWEZNQCLSA-N 1 1 378.567 3.343 10 0 GGAEMO C[C@H]1C[C@H](N(C)Cc2noc(Cc3ccc(Br)cc3)n2)CC[N@H+]1C ZINC000177058109 565825079 /nfs/dbraw/zinc/82/50/79/565825079.db2.gz IINJYCFSUMCULG-XJKSGUPXSA-N 1 1 393.329 3.337 10 0 GGAEMO O=C(NC1CC[NH+](Cc2cccc(Br)c2)CC1)[C@H]1CCCOCC1 ZINC000412979088 565826697 /nfs/dbraw/zinc/82/66/97/565826697.db2.gz ZAOJWIODRQXYLG-INIZCTEOSA-N 1 1 395.341 3.346 10 0 GGAEMO Cc1[nH]nc(C(=O)NC2CC[NH+](Cc3cccc(Br)c3)CC2)c1C ZINC000412976219 565826848 /nfs/dbraw/zinc/82/68/48/565826848.db2.gz VUPSHUPTWYGSJZ-UHFFFAOYSA-N 1 1 391.313 3.183 10 0 GGAEMO CCOc1c(Br)cc(C(=O)N[C@H]2CCC[N@@H+](CC)C2)cc1OC ZINC000194625402 565827670 /nfs/dbraw/zinc/82/76/70/565827670.db2.gz SZSPNPPXYQKMHD-ZDUSSCGKSA-N 1 1 385.302 3.071 10 0 GGAEMO C[N@H+]1CCC[C@H]1CNC(=O)c1ccc(COc2cccc(Br)c2)o1 ZINC000194695218 565831304 /nfs/dbraw/zinc/83/13/04/565831304.db2.gz YDIAZSGRQVXBBK-AWEZNQCLSA-N 1 1 393.281 3.445 10 0 GGAEMO CCc1c(C(=O)NC[C@@H]2CCC[N@H+]2C)cnn1-c1ccc(Br)cc1 ZINC000194695576 565831373 /nfs/dbraw/zinc/83/13/73/565831373.db2.gz BQQXWMUSWWCCGC-HNNXBMFYSA-N 1 1 391.313 3.021 10 0 GGAEMO COc1cc(Br)c(NC(=O)N2C[C@H]3CCC[N@H+]3C[C@H]2C)cc1OC ZINC000177147411 565831880 /nfs/dbraw/zinc/83/18/80/565831880.db2.gz BBJRKJQHUWMUNP-VXGBXAGGSA-N 1 1 398.301 3.167 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1cccc(I)c1 ZINC000177159058 565831920 /nfs/dbraw/zinc/83/19/20/565831920.db2.gz CKZFMVVINGHIPF-OAHLLOKOSA-N 1 1 395.244 3.101 10 0 GGAEMO COc1ccc(Br)c(C(=O)N2CCC[C@@H]2Cn2cc[nH+]c2C)c1 ZINC000177184308 565832953 /nfs/dbraw/zinc/83/29/53/565832953.db2.gz VYLBKJIISRPMKP-CYBMUJFWSA-N 1 1 378.270 3.267 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1ccc(I)cc1 ZINC000177200358 565834369 /nfs/dbraw/zinc/83/43/69/565834369.db2.gz QRNFLVVENQULIG-HNNXBMFYSA-N 1 1 395.244 3.101 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)[C@H](C)Oc1cccc(Br)c1 ZINC000177197536 565834406 /nfs/dbraw/zinc/83/44/06/565834406.db2.gz BBCMGGGWEYRIOO-XJKSGUPXSA-N 1 1 392.297 3.413 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1ccccc1I ZINC000177195233 565834631 /nfs/dbraw/zinc/83/46/31/565834631.db2.gz MBYLRRGCYGBBKL-ZDUSSCGKSA-N 1 1 395.244 3.101 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)[C@H](C)Oc1ccccc1Br ZINC000177209508 565836364 /nfs/dbraw/zinc/83/63/64/565836364.db2.gz JRRJRZVHWQAOMD-DZGCQCFKSA-N 1 1 392.297 3.413 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)c1[nH]nc(C(C)C)c1Br ZINC000177207469 565836453 /nfs/dbraw/zinc/83/64/53/565836453.db2.gz VRNIVPAGFIKNCR-GFCCVEGCSA-N 1 1 380.290 3.105 10 0 GGAEMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2[nH]nc3ccc(Br)cc32)C1 ZINC000177279461 565840682 /nfs/dbraw/zinc/84/06/82/565840682.db2.gz NAKYNDNAVFITEI-LBPRGKRZSA-N 1 1 379.302 3.033 10 0 GGAEMO CC(C)C[N@@H+]1CC[C@@H](CNC(=O)c2n[nH]c3ccc(Br)cc32)C1 ZINC000177279461 565840688 /nfs/dbraw/zinc/84/06/88/565840688.db2.gz NAKYNDNAVFITEI-LBPRGKRZSA-N 1 1 379.302 3.033 10 0 GGAEMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2n[nH]c3ccc(Br)cc32)C1 ZINC000177279461 565840691 /nfs/dbraw/zinc/84/06/91/565840691.db2.gz NAKYNDNAVFITEI-LBPRGKRZSA-N 1 1 379.302 3.033 10 0 GGAEMO C[C@H]1C[C@H]([NH+]2CCOCC2)CN1c1nccc2cc(Br)ccc21 ZINC000413275245 565842932 /nfs/dbraw/zinc/84/29/32/565842932.db2.gz AYDASVCSALNSNV-BBRMVZONSA-N 1 1 376.298 3.297 10 0 GGAEMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)NCc1cc(F)cc(Br)c1 ZINC000194902750 565846826 /nfs/dbraw/zinc/84/68/26/565846826.db2.gz XAXFZBRVKWHTQB-LLVKDONJSA-N 1 1 383.265 3.229 10 0 GGAEMO O=S(=O)(CCC(F)(F)F)NC1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000284265374 565847519 /nfs/dbraw/zinc/84/75/19/565847519.db2.gz LBWIIIURQKDHHV-MQVJKMGUSA-N 1 1 376.444 3.054 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)NCc1ccc(OC)c(Br)c1 ZINC000177463002 565853063 /nfs/dbraw/zinc/85/30/63/565853063.db2.gz FNOVOSJBVPGMJR-AWEZNQCLSA-N 1 1 384.318 3.083 10 0 GGAEMO CO[C@@H](C)[C@@H](C)NC(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000413554225 565859045 /nfs/dbraw/zinc/85/90/45/565859045.db2.gz PRKVQUHTUPJAKK-KGLIPLIRSA-N 1 1 398.345 3.136 10 0 GGAEMO CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)N1CC[N@H+]2CCC[C@H]2C1 ZINC000177698607 565868033 /nfs/dbraw/zinc/86/80/33/565868033.db2.gz MIIHNTOURGXDCN-ZDUSSCGKSA-N 1 1 381.929 3.086 10 0 GGAEMO CC(C)Sc1ccc(Cl)cc1NC(=O)C(=O)N1CC[N@H+]2CCC[C@H]2C1 ZINC000177697424 565868081 /nfs/dbraw/zinc/86/80/81/565868081.db2.gz CGSCIDVAWGXZSH-AWEZNQCLSA-N 1 1 381.929 3.086 10 0 GGAEMO CN(C(=O)NCc1cc(Cl)cc(Br)c1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000413701011 565868945 /nfs/dbraw/zinc/86/89/45/565868945.db2.gz LGBITAIOHOVZML-OAHLLOKOSA-N 1 1 386.721 3.481 10 0 GGAEMO O=C(Nc1nc(SCc2ccccc2)ns1)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000177710259 565869533 /nfs/dbraw/zinc/86/95/33/565869533.db2.gz XLBWDJXDOVRHKO-CQSZACIVSA-N 1 1 375.523 3.142 10 0 GGAEMO Cc1ccc(Cc2nc([C@@H]3C[N@@H+]4CCC[C@@H]4CO3)no2)c(Br)c1 ZINC000333215846 565871788 /nfs/dbraw/zinc/87/17/88/565871788.db2.gz UWTIUSNGVMWWLF-HIFRSBDPSA-N 1 1 378.270 3.267 10 0 GGAEMO Cc1ccc(Cc2nc([C@@H]3C[N@H+]4CCC[C@@H]4CO3)no2)c(Br)c1 ZINC000333215846 565871792 /nfs/dbraw/zinc/87/17/92/565871792.db2.gz UWTIUSNGVMWWLF-HIFRSBDPSA-N 1 1 378.270 3.267 10 0 GGAEMO 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ZINC000287955456 566049998 /nfs/dbraw/zinc/04/99/98/566049998.db2.gz VLFGSRJPKFMDGK-JLZZUVOBSA-N 1 1 395.345 3.419 10 0 GGAEMO C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000247030916 566050466 /nfs/dbraw/zinc/05/04/66/566050466.db2.gz NPBRHRBGULOCBD-WFASDCNBSA-N 1 1 376.298 3.168 10 0 GGAEMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)CCCc1cc(Cl)sc1Cl ZINC000416285056 566050713 /nfs/dbraw/zinc/05/07/13/566050713.db2.gz BLVJEDHDLUQGOY-NWDGAFQWSA-N 1 1 379.353 3.291 10 0 GGAEMO C[C@H]1C[N@H+]2CCC[C@H]2CN1CC(=O)Nc1ccc(Br)cc1Cl ZINC000247054153 566051436 /nfs/dbraw/zinc/05/14/36/566051436.db2.gz HAWWQALJMRTJPA-AAEUAGOBSA-N 1 1 386.721 3.210 10 0 GGAEMO CCCO[C@@H]1CCC[N@@H+](C[C@@H](O)COc2cccc(Br)c2)CC1 ZINC000247073123 566051677 /nfs/dbraw/zinc/05/16/77/566051677.db2.gz HSOSLRFUANYGQL-IAGOWNOFSA-N 1 1 386.330 3.470 10 0 GGAEMO C[C@H](Cc1ccc(F)c(Br)c1)C(=O)N1C[C@@H]2CCC[N@H+]2C[C@@H]1C ZINC000247076045 566052078 /nfs/dbraw/zinc/05/20/78/566052078.db2.gz QNFXSBSCRADISP-IPYPFGDCSA-N 1 1 383.305 3.462 10 0 GGAEMO C[C@@H]1C[N@H+](CCO)[C@H](C)CN1C(=O)c1cccc2cccc(Br)c21 ZINC000416285369 566052202 /nfs/dbraw/zinc/05/22/02/566052202.db2.gz CAPKJNLDTHIKLD-ZIAGYGMSSA-N 1 1 391.309 3.129 10 0 GGAEMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1C(=O)c1cccc2cccc(Br)c21 ZINC000416285369 566052206 /nfs/dbraw/zinc/05/22/06/566052206.db2.gz CAPKJNLDTHIKLD-ZIAGYGMSSA-N 1 1 391.309 3.129 10 0 GGAEMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)CCCCc1ccc(Br)cc1 ZINC000416294323 566052320 /nfs/dbraw/zinc/05/23/20/566052320.db2.gz KUOPJJHOAUDHJF-JKSUJKDBSA-N 1 1 397.357 3.075 10 0 GGAEMO C[C@@H]1C[N@H+](CCO)[C@@H](C)CN1C(=O)c1csc(-c2ccc(Cl)s2)n1 ZINC000416300033 566052339 /nfs/dbraw/zinc/05/23/39/566052339.db2.gz SUNANMMZTQBJGA-WDEREUQCSA-N 1 1 385.942 3.052 10 0 GGAEMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)c1csc(-c2ccc(Cl)s2)n1 ZINC000416300033 566052341 /nfs/dbraw/zinc/05/23/41/566052341.db2.gz SUNANMMZTQBJGA-WDEREUQCSA-N 1 1 385.942 3.052 10 0 GGAEMO C[C@@H]1CN(C(=O)c2cccc3cccc(Br)c32)[C@@H](C)C[N@@H+]1CCO ZINC000416285366 566052406 /nfs/dbraw/zinc/05/24/06/566052406.db2.gz CAPKJNLDTHIKLD-KGLIPLIRSA-N 1 1 391.309 3.129 10 0 GGAEMO C[C@@H]1CN(C(=O)c2cccc3cccc(Br)c32)[C@@H](C)C[N@H+]1CCO ZINC000416285366 566052410 /nfs/dbraw/zinc/05/24/10/566052410.db2.gz CAPKJNLDTHIKLD-KGLIPLIRSA-N 1 1 391.309 3.129 10 0 GGAEMO CS(=O)(=O)N1CCC[C@@H](C[N@H+]2CCC[C@H]2c2nc3ccccc3s2)C1 ZINC000247107352 566053124 /nfs/dbraw/zinc/05/31/24/566053124.db2.gz DRRRQPXORHBYNR-HOCLYGCPSA-N 1 1 379.551 3.105 10 0 GGAEMO CSc1cc(C(=O)N2C[C@@H](C)[N@H+](CCO)C[C@@H]2C)c(Cl)cc1Cl ZINC000416313301 566053372 /nfs/dbraw/zinc/05/33/72/566053372.db2.gz RJYSZGSEVQESPR-MNOVXSKESA-N 1 1 377.337 3.242 10 0 GGAEMO CSc1cc(C(=O)N2C[C@@H](C)[N@@H+](CCO)C[C@@H]2C)c(Cl)cc1Cl ZINC000416313301 566053375 /nfs/dbraw/zinc/05/33/75/566053375.db2.gz RJYSZGSEVQESPR-MNOVXSKESA-N 1 1 377.337 3.242 10 0 GGAEMO Cc1cc(Br)cc2c(C(=O)N3C[C@@H](C)[N@@H+](CCO)C[C@@H]3C)coc21 ZINC000416313909 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1 1 394.309 3.493 10 0 GGAEMO c1sc(-c2ccc3c(c2)OCO3)nc1C[N@@H+]1CCS[C@@H]2COCC[C@H]21 ZINC000247327322 566058007 /nfs/dbraw/zinc/05/80/07/566058007.db2.gz WPPOXGKUEDKZAZ-RHSMWYFYSA-N 1 1 376.503 3.245 10 0 GGAEMO c1sc(-c2ccc3c(c2)OCO3)nc1C[N@H+]1CCS[C@@H]2COCC[C@H]21 ZINC000247327322 566058011 /nfs/dbraw/zinc/05/80/11/566058011.db2.gz WPPOXGKUEDKZAZ-RHSMWYFYSA-N 1 1 376.503 3.245 10 0 GGAEMO Cc1ccc(I)c(C(=O)N(C)[C@H]2CC[N@H+](C)C[C@H]2C)c1 ZINC000247361441 566058862 /nfs/dbraw/zinc/05/88/62/566058862.db2.gz KDWYQASBGFCEIE-DOMZBBRYSA-N 1 1 386.277 3.012 10 0 GGAEMO C[C@H](Oc1ccc(F)cc1Br)C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000247342219 566058979 /nfs/dbraw/zinc/05/89/79/566058979.db2.gz JFNAYDGQBIJKOU-SGMGOOAPSA-N 1 1 387.293 3.297 10 0 GGAEMO C[C@H](Oc1ccc(F)cc1Br)C(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000247342210 566059391 /nfs/dbraw/zinc/05/93/91/566059391.db2.gz JFNAYDGQBIJKOU-OBJOEFQTSA-N 1 1 387.293 3.297 10 0 GGAEMO 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COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1cc(Br)cs1 ZINC000262028524 566144403 /nfs/dbraw/zinc/14/44/03/566144403.db2.gz SBRGFRHGQFRKKI-CYBMUJFWSA-N 1 1 381.295 3.306 10 0 GGAEMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1ccc(F)cc1Br ZINC000262047530 566145260 /nfs/dbraw/zinc/14/52/60/566145260.db2.gz USIHMYXNLLCDRC-MRXNPFEDSA-N 1 1 393.256 3.384 10 0 GGAEMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)Cc1cccc(Br)c1 ZINC000262064771 566145382 /nfs/dbraw/zinc/14/53/82/566145382.db2.gz WFHHCJIAZUDXPP-KRWDZBQOSA-N 1 1 389.293 3.173 10 0 GGAEMO COc1ccc([C@@H](C)[NH2+]Cc2cccnc2-n2cncn2)c(Br)c1 ZINC000181503894 566146069 /nfs/dbraw/zinc/14/60/69/566146069.db2.gz ALKONEYICLWLNK-GFCCVEGCSA-N 1 1 388.269 3.284 10 0 GGAEMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1cc(Br)ccc1F ZINC000262099606 566147329 /nfs/dbraw/zinc/14/73/29/566147329.db2.gz ZEPKFSJSGLHXDN-MRXNPFEDSA-N 1 1 393.256 3.384 10 0 GGAEMO Cc1nc(SC(F)F)sc1CC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000366408001 566150767 /nfs/dbraw/zinc/15/07/67/566150767.db2.gz 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ZINC000417778737 566175117 /nfs/dbraw/zinc/17/51/17/566175117.db2.gz GENWLBXLYRBCHG-SWLSCSKDSA-N 1 1 375.225 3.431 10 0 GGAEMO Cc1c[nH]nc1C[NH+]1CCC(C(=O)Nc2ccccc2Br)CC1 ZINC000290581714 566179553 /nfs/dbraw/zinc/17/95/53/566179553.db2.gz ZMZPDMKEBFPHQY-UHFFFAOYSA-N 1 1 377.286 3.331 10 0 GGAEMO COc1cc(Br)ccc1C[N@@H+]1CCC[C@@H](C(=O)NCC2CC2)C1 ZINC000182086175 566181853 /nfs/dbraw/zinc/18/18/53/566181853.db2.gz UIAZLUCNAOQFEU-OAHLLOKOSA-N 1 1 381.314 3.196 10 0 GGAEMO COc1cc(Br)ccc1C[N@H+]1CCC[C@@H](C(=O)NCC2CC2)C1 ZINC000182086175 566181857 /nfs/dbraw/zinc/18/18/57/566181857.db2.gz UIAZLUCNAOQFEU-OAHLLOKOSA-N 1 1 381.314 3.196 10 0 GGAEMO C[N@H+]1CCCC12CCN(C(=O)c1cc(Br)cc3nc[nH]c31)CC2 ZINC000367070818 566183123 /nfs/dbraw/zinc/18/31/23/566183123.db2.gz GZPVGFZBLPMHTI-UHFFFAOYSA-N 1 1 377.286 3.026 10 0 GGAEMO O=C(CC[N@H+]1CC[C@@]2(C1)CCCOC2)Nc1ccc(Br)cc1F ZINC000367056029 566183150 /nfs/dbraw/zinc/18/31/50/566183150.db2.gz VKJHJMGEKKQAOS-QGZVFWFLSA-N 1 1 385.277 3.419 10 0 GGAEMO NS(=O)(=O)c1ccc2c(c1)[C@H]([NH2+]Cc1cc(F)c(Cl)cc1F)CCC2 ZINC000290666973 566183928 /nfs/dbraw/zinc/18/39/28/566183928.db2.gz LASIGWSEFLEPBK-QGZVFWFLSA-N 1 1 386.851 3.433 10 0 GGAEMO COc1cc(Br)ccc1C[N@@H+]1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000182167770 566186398 /nfs/dbraw/zinc/18/63/98/566186398.db2.gz BMVONYUIOFGYLU-CQSZACIVSA-N 1 1 391.313 3.375 10 0 GGAEMO COc1cc(Br)ccc1C[N@H+]1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000182167770 566186402 /nfs/dbraw/zinc/18/64/02/566186402.db2.gz BMVONYUIOFGYLU-CQSZACIVSA-N 1 1 391.313 3.375 10 0 GGAEMO COc1cc(Br)ccc1C[N@@H+](C)[C@@H]1CCCN(c2cccnn2)C1 ZINC000182170319 566186521 /nfs/dbraw/zinc/18/65/21/566186521.db2.gz RHECNNQNPJMGLN-MRXNPFEDSA-N 1 1 391.313 3.349 10 0 GGAEMO COc1cc(Br)ccc1C[N@@H+]1CCCN(c2ccc(C)nn2)CC1 ZINC000182170253 566186787 /nfs/dbraw/zinc/18/67/87/566186787.db2.gz BFFFCSZBAWLCIE-UHFFFAOYSA-N 1 1 391.313 3.268 10 0 GGAEMO COc1cc(Br)ccc1C[N@H+]1CCCN(c2ccc(C)nn2)CC1 ZINC000182170253 566186792 /nfs/dbraw/zinc/18/67/92/566186792.db2.gz 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CC(C)(CNC(=O)c1n[nH]c2ccc(Br)cc21)C[NH+]1CCCC1 ZINC000482969043 566346203 /nfs/dbraw/zinc/34/62/03/566346203.db2.gz BNFMANJJFBDGJT-UHFFFAOYSA-N 1 1 379.302 3.177 10 0 GGAEMO CCC[N@H+]1CCC[C@@H]1C(=O)N[C@@H]1CCN(c2ccccc2Br)C1 ZINC000600577710 566347354 /nfs/dbraw/zinc/34/73/54/566347354.db2.gz KSOFXBZLXDENJS-RHSMWYFYSA-N 1 1 380.330 3.018 10 0 GGAEMO CN(C(=O)c1cc(-c2ccc(Br)cc2)n[nH]1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000600570332 566347920 /nfs/dbraw/zinc/34/79/20/566347920.db2.gz AMADSZDFBALHHL-HNNXBMFYSA-N 1 1 389.297 3.148 10 0 GGAEMO O=S(=O)(C1CC1)N1CCC[N@H+](Cc2ccc(-c3cccs3)cc2)CC1 ZINC000670105522 566349078 /nfs/dbraw/zinc/34/90/78/566349078.db2.gz MGMAETWAQMLORI-UHFFFAOYSA-N 1 1 376.547 3.415 10 0 GGAEMO O=S(=O)(C1CC1)N1CCC[N@@H+](Cc2ccc(-c3cccs3)cc2)CC1 ZINC000670105522 566349083 /nfs/dbraw/zinc/34/90/83/566349083.db2.gz MGMAETWAQMLORI-UHFFFAOYSA-N 1 1 376.547 3.415 10 0 GGAEMO COC(=O)[C@H](NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccccc1Br ZINC000600614149 566350255 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C[C@@H](NC(=O)c1ccc2scc(Br)c2c1)[C@@H]1C[N@H+](C)CCO1 ZINC000649200460 566353211 /nfs/dbraw/zinc/35/32/11/566353211.db2.gz RRKXSPZXCIRSMA-YGRLFVJLSA-N 1 1 383.311 3.113 10 0 GGAEMO C[C@@H](NC(=O)c1ccc2scc(Br)c2c1)[C@@H]1C[N@@H+](C)CCO1 ZINC000649200460 566353217 /nfs/dbraw/zinc/35/32/17/566353217.db2.gz RRKXSPZXCIRSMA-YGRLFVJLSA-N 1 1 383.311 3.113 10 0 GGAEMO CCC[N@H+]1CCC[C@H]1C(=O)NCc1nc2cc(Br)ccc2n1CC ZINC000483046437 566353598 /nfs/dbraw/zinc/35/35/98/566353598.db2.gz JUBWAICNUUEEII-INIZCTEOSA-N 1 1 393.329 3.309 10 0 GGAEMO CC(C)[C@@H](NC(=O)c1ccc(Cl)s1)C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000510024570 566357446 /nfs/dbraw/zinc/35/74/46/566357446.db2.gz VZENNTJAZYNCAF-XJKCOSOUSA-N 1 1 385.961 3.097 10 0 GGAEMO O=C(N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1)C1(c2cccc(Br)c2)CC1 ZINC000670378379 566358756 /nfs/dbraw/zinc/35/87/56/566358756.db2.gz XWEBDIVBDGYEGX-HZPDHXFCSA-N 1 1 381.289 3.125 10 0 GGAEMO COc1cc(Br)ccc1[C@@H]1CCCN1C[C@H](O)C[N@@H+](C)C(C)C ZINC000625795818 566358931 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CC1(C)C[N@@H+](CCOc2cc(F)cc(Br)c2)C[C@@]2(CCOC2)O1 ZINC000483184402 566362272 /nfs/dbraw/zinc/36/22/72/566362272.db2.gz LJHXIBWJVAVUOR-QGZVFWFLSA-N 1 1 388.277 3.237 10 0 GGAEMO COc1cc(C[N@@H+]2CC[C@H](O)C2(C)C)cc(Br)c1OC(F)F ZINC000462870276 566362564 /nfs/dbraw/zinc/36/25/64/566362564.db2.gz JGJXKICRZFPFDF-LBPRGKRZSA-N 1 1 380.229 3.404 10 0 GGAEMO COc1cc(C[N@H+]2CC[C@H](O)C2(C)C)cc(Br)c1OC(F)F ZINC000462870276 566362569 /nfs/dbraw/zinc/36/25/69/566362569.db2.gz JGJXKICRZFPFDF-LBPRGKRZSA-N 1 1 380.229 3.404 10 0 GGAEMO C[C@]1(F)C[NH2+]CCN(C(=O)c2ccc(Br)c(C(F)(F)F)c2)C1 ZINC000649364482 566363567 /nfs/dbraw/zinc/36/35/67/566363567.db2.gz KSDVJTNKQYNICC-ZDUSSCGKSA-N 1 1 383.183 3.242 10 0 GGAEMO CC[C@@H]1C[N@@H+](CCOc2cc(F)cc(Br)c2)C[C@]2(CCOC2)O1 ZINC000483200889 566364511 /nfs/dbraw/zinc/36/45/11/566364511.db2.gz QRSCVPKQLBGORL-WBVHZDCISA-N 1 1 388.277 3.237 10 0 GGAEMO Cc1c(Cl)c(C[NH2+]CCC(=O)Nc2ccc(Br)cc2)nn1C ZINC000421324731 566364987 /nfs/dbraw/zinc/36/49/87/566364987.db2.gz KJCKGJNIPVXTQD-UHFFFAOYSA-N 1 1 385.693 3.263 10 0 GGAEMO COC(=O)[C@@H]1C[N@H+](Cc2nn(C)c(C)c2Cl)C[C@H]1c1ccc(Cl)cc1 ZINC000421351085 566366524 /nfs/dbraw/zinc/36/65/24/566366524.db2.gz BLPWUCOCNDJUPY-LSDHHAIUSA-N 1 1 382.291 3.424 10 0 GGAEMO COC(=O)[C@@H]1C[N@@H+](Cc2nn(C)c(C)c2Cl)C[C@H]1c1ccc(Cl)cc1 ZINC000421351085 566366533 /nfs/dbraw/zinc/36/65/33/566366533.db2.gz BLPWUCOCNDJUPY-LSDHHAIUSA-N 1 1 382.291 3.424 10 0 GGAEMO Cc1c(Cl)c(C[NH2+]C[C@@H](CO)Cc2ccccc2Br)nn1C ZINC000421348812 566366807 /nfs/dbraw/zinc/36/68/07/566366807.db2.gz BTEJOQWAOVMMEA-LBPRGKRZSA-N 1 1 386.721 3.085 10 0 GGAEMO Cc1c(Cl)c(C[NH2+]C[C@H](CO)Cc2ccccc2C(F)(F)F)nn1C ZINC000421342150 566366953 /nfs/dbraw/zinc/36/69/53/566366953.db2.gz MVPSNUGMTYANOH-GFCCVEGCSA-N 1 1 375.822 3.342 10 0 GGAEMO C[C@@H]1OCC[C@@H]1[N@H+](CCO)CC(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000483294065 566371674 /nfs/dbraw/zinc/37/16/74/566371674.db2.gz HOEUHGLCENDWCM-XPTSAGLGSA-N 1 1 381.687 3.057 10 0 GGAEMO 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ZINC000449299691 566546484 /nfs/dbraw/zinc/54/64/84/566546484.db2.gz MLZKQMRGMHVTQV-GXTWGEPZSA-N 1 1 381.314 3.360 10 0 GGAEMO C[N@@H+](CC(=O)NCC/C=C/c1ccc(Br)cc1)[C@@H]1CCSC1 ZINC000628335249 566547596 /nfs/dbraw/zinc/54/75/96/566547596.db2.gz HVLNWHWMIANISS-WPTTZPOMSA-N 1 1 383.355 3.406 10 0 GGAEMO C[N@@H+](CC(=O)NCC/C=C\c1ccc(Br)cc1)[C@H]1CCSC1 ZINC000628335248 566547796 /nfs/dbraw/zinc/54/77/96/566547796.db2.gz HVLNWHWMIANISS-OUMXJLHTSA-N 1 1 383.355 3.406 10 0 GGAEMO Cc1cc(Br)c(C[NH2+][C@H](C)C2(S(C)(=O)=O)CC2)cc1Cl ZINC000449323157 566547882 /nfs/dbraw/zinc/54/78/82/566547882.db2.gz SEBGOIQQOCCRAB-SNVBAGLBSA-N 1 1 380.735 3.466 10 0 GGAEMO Brc1ccc(-c2n[nH]cc2C[N@H+]2CC[C@@H](Cn3ccnn3)C2)s1 ZINC000628336607 566548880 /nfs/dbraw/zinc/54/88/80/566548880.db2.gz LAHYKAIBCSKDEF-LLVKDONJSA-N 1 1 393.314 3.014 10 0 GGAEMO O=C(Nc1nncs1)C1CC[NH+](Cc2cccc(F)c2Br)CC1 ZINC000449325923 566551032 /nfs/dbraw/zinc/55/10/32/566551032.db2.gz QOPQAFOZPJECJU-UHFFFAOYSA-N 1 1 399.289 3.290 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(Cc3ccnc4c(Br)cccc34)[C@H]2C1 ZINC000449337485 566551104 /nfs/dbraw/zinc/55/11/04/566551104.db2.gz BNBQKPXSAYESJL-ZWKOTPCHSA-N 1 1 390.325 3.292 10 0 GGAEMO CCCOc1ccc(Br)cc1C[N@@H+](C)[C@H]1CCN2CCO[C@H]1C2 ZINC000449362258 566551720 /nfs/dbraw/zinc/55/17/20/566551720.db2.gz KQMXMVJFIUJDQB-WMZOPIPTSA-N 1 1 383.330 3.143 10 0 GGAEMO CC[N@H+](Cc1cn(-c2ccc(Cl)c(Cl)c2)nc1C(=O)OC)[C@@H](C)CO ZINC000449345017 566552031 /nfs/dbraw/zinc/55/20/31/566552031.db2.gz TYUHTGYVDUNAII-NSHDSACASA-N 1 1 386.279 3.168 10 0 GGAEMO CC[N@@H+](Cc1cn(-c2ccc(Cl)c(Cl)c2)nc1C(=O)OC)[C@@H](C)CO ZINC000449345017 566552036 /nfs/dbraw/zinc/55/20/36/566552036.db2.gz TYUHTGYVDUNAII-NSHDSACASA-N 1 1 386.279 3.168 10 0 GGAEMO Brc1ccccc1-n1cc(C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)nn1 ZINC000628423035 566554126 /nfs/dbraw/zinc/55/41/26/566554126.db2.gz ZGBHZDRBSWTOEE-KGLIPLIRSA-N 1 1 379.327 3.500 10 0 GGAEMO C[N@H+]1CCC[C@@]2(CCN(S(=O)(=O)Cc3cc(Cl)sc3Cl)C2)C1 ZINC000651717777 566555114 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O[C@@H]1C[C@@H]([C@H]2CCCOC2)[N@@H+](Cc2ccc(Br)c3cccnc23)C1 ZINC000449431187 566562638 /nfs/dbraw/zinc/56/26/38/566562638.db2.gz CYQPZTSXDSIKCJ-DAYGRLMNSA-N 1 1 391.309 3.359 10 0 GGAEMO O[C@@H]1C[C@@H]([C@@H]2CCCOC2)[N@@H+](CC2=Cc3cc(Br)ccc3OC2)C1 ZINC000449434737 566562723 /nfs/dbraw/zinc/56/27/23/566562723.db2.gz SHVFQELOUORYGK-OLMNPRSZSA-N 1 1 394.309 3.087 10 0 GGAEMO O[C@@H]1C[C@@H]([C@@H]2CCCOC2)[N@@H+](Cc2ccnc3c(Br)cccc23)C1 ZINC000449433578 566562877 /nfs/dbraw/zinc/56/28/77/566562877.db2.gz MXJSXROGGVIUKO-RKVPGOIHSA-N 1 1 391.309 3.359 10 0 GGAEMO C[C@H](CNC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1)Oc1cccc(Br)c1 ZINC000466300081 566564648 /nfs/dbraw/zinc/56/46/48/566564648.db2.gz VWFFFAQXZRSMDQ-SQWLQELKSA-N 1 1 398.345 3.341 10 0 GGAEMO C[C@H](CNC(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1)Oc1cccc(Br)c1 ZINC000466300080 566564945 /nfs/dbraw/zinc/56/49/45/566564945.db2.gz VWFFFAQXZRSMDQ-LZWOXQAQSA-N 1 1 398.345 3.341 10 0 GGAEMO C[C@H](CNC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1)Oc1cccc(Br)c1 ZINC000466300079 566565054 /nfs/dbraw/zinc/56/50/54/566565054.db2.gz VWFFFAQXZRSMDQ-IIAWOOMASA-N 1 1 398.345 3.341 10 0 GGAEMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000424737958 566565053 /nfs/dbraw/zinc/56/50/53/566565053.db2.gz LZBFAIZVVNINIP-LRDDRELGSA-N 1 1 392.297 3.076 10 0 GGAEMO Cc1[nH+]ccn1CCCN(C)C(=O)Cc1noc2ccc(Br)cc12 ZINC000424739734 566565162 /nfs/dbraw/zinc/56/51/62/566565162.db2.gz QULNFQLAFPZOJK-UHFFFAOYSA-N 1 1 391.269 3.186 10 0 GGAEMO C[C@H](CC(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1)n1cc(Br)cn1 ZINC000628543914 566565427 /nfs/dbraw/zinc/56/54/27/566565427.db2.gz VYZLQCPZOTUAQV-CJNGLKHVSA-N 1 1 383.334 3.120 10 0 GGAEMO CC[N@H+]1C[C@H](C)N(C(=O)Cc2noc3ccc(Br)cc32)C[C@H]1C ZINC000424747235 566566191 /nfs/dbraw/zinc/56/61/91/566566191.db2.gz MRDJLSUNGUPJEB-NEPJUHHUSA-N 1 1 380.286 3.074 10 0 GGAEMO C[N@H+]1CCCC12CCN(C(=O)Cc1noc3ccc(Br)cc31)CC2 ZINC000424753397 566566590 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/nfs/dbraw/zinc/79/47/23/566794723.db2.gz MPXMLFGSEWCRDZ-UHFFFAOYSA-N 1 1 389.293 3.497 10 0 GGAEMO COc1c(Br)ccc(C)c1C(=O)NCc1c[nH+]c2n1CCCC2 ZINC000516965671 566796924 /nfs/dbraw/zinc/79/69/24/566796924.db2.gz HDDWYBGBSDBEKG-UHFFFAOYSA-N 1 1 378.270 3.229 10 0 GGAEMO C[N@H+](CC(=O)N1CCC[C@@H](C(F)(F)F)C1)[C@@H](CO)c1ccc(Cl)cc1 ZINC000451326117 566797280 /nfs/dbraw/zinc/79/72/80/566797280.db2.gz CGKXEFRAKAJRRU-HIFRSBDPSA-N 1 1 378.822 3.106 10 0 GGAEMO C[N@@H+](CC(=O)N1CCC[C@@H](C(F)(F)F)C1)[C@@H](CO)c1ccc(Cl)cc1 ZINC000451326117 566797282 /nfs/dbraw/zinc/79/72/82/566797282.db2.gz CGKXEFRAKAJRRU-HIFRSBDPSA-N 1 1 378.822 3.106 10 0 GGAEMO C[C@@H](CCNC(=O)c1cc[nH]c(=O)c1Br)[N@@H+](C)Cc1ccccc1 ZINC000469552499 566798122 /nfs/dbraw/zinc/79/81/22/566798122.db2.gz SSBMVAIMYNEZJX-ZDUSSCGKSA-N 1 1 392.297 3.190 10 0 GGAEMO C[C@H](CCNC(=O)c1cc[nH]c(=O)c1Br)[N@@H+](C)Cc1ccccc1 ZINC000469552498 566798288 /nfs/dbraw/zinc/79/82/88/566798288.db2.gz SSBMVAIMYNEZJX-CYBMUJFWSA-N 1 1 392.297 3.190 10 0 GGAEMO OC1([C@H]2CCCC[N@@H+]2Cc2nc(Cc3cccc(Br)c3)no2)CC1 ZINC000517015867 566799285 /nfs/dbraw/zinc/79/92/85/566799285.db2.gz IMTCZRBFVLXXRR-OAHLLOKOSA-N 1 1 392.297 3.302 10 0 GGAEMO OC1([C@H]2CCCC[N@H+]2Cc2nc(Cc3cccc(Br)c3)no2)CC1 ZINC000517015867 566799291 /nfs/dbraw/zinc/79/92/91/566799291.db2.gz IMTCZRBFVLXXRR-OAHLLOKOSA-N 1 1 392.297 3.302 10 0 GGAEMO O=C([C@H]1CCC[N@H+](CCCSc2ccccc2Cl)C1)N1CCOCC1 ZINC000489619196 566799460 /nfs/dbraw/zinc/79/94/60/566799460.db2.gz GXRLHXKUQHJYEP-INIZCTEOSA-N 1 1 382.957 3.393 10 0 GGAEMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)[C@H]1CCc2cc(Br)ccc21 ZINC000517032229 566801635 /nfs/dbraw/zinc/80/16/35/566801635.db2.gz QQEFGBMWIOIKNL-PXAZEXFGSA-N 1 1 376.298 3.436 10 0 GGAEMO C[C@H](CCNC(=O)c1n[nH]c2ccc(Br)cc21)[NH+]1CCCCC1 ZINC000542451591 566801996 /nfs/dbraw/zinc/80/19/96/566801996.db2.gz LLBYWABFNGYYJQ-GFCCVEGCSA-N 1 1 379.302 3.320 10 0 GGAEMO CSc1cc(Br)ccc1C(=O)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000655459683 566802151 /nfs/dbraw/zinc/80/21/51/566802151.db2.gz OHKCYFKHQMTIBL-HNNXBMFYSA-N 1 1 392.322 3.353 10 0 GGAEMO C[N@H+]1CC[C@@H](NS(=O)(=O)Cc2c(F)cccc2Cl)[C@H]1c1ccccc1 ZINC000451351231 566802593 /nfs/dbraw/zinc/80/25/93/566802593.db2.gz INDATWUIHHEXOA-QZTJIDSGSA-N 1 1 382.888 3.344 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2csc(CCC(F)(F)F)n2)[C@H](C)C1 ZINC000631463994 566805412 /nfs/dbraw/zinc/80/54/12/566805412.db2.gz CPOMOJYUDQQUDW-TZMCWYRMSA-N 1 1 377.476 3.369 10 0 GGAEMO CCC1(NC(=O)Nc2cc(Br)cnc2N2CC[NH+](C)CC2)CCC1 ZINC000562620444 566807507 /nfs/dbraw/zinc/80/75/07/566807507.db2.gz DGGLJODJRGWCCY-UHFFFAOYSA-N 1 1 396.333 3.050 10 0 GGAEMO CC(C)(C)[C@@H]1CC[N@@H+](C[C@@H](O)COc2cc(Cl)ccc2Cl)C[C@@H]1O ZINC000542547032 566810535 /nfs/dbraw/zinc/81/05/35/566810535.db2.gz SYOVKYNZYMLWPH-FMKPAKJESA-N 1 1 376.324 3.462 10 0 GGAEMO CC[C@H](CO)[NH+]1CCN(C(=O)C2(c3c(Cl)cccc3Cl)CCC2)CC1 ZINC000469753065 566811348 /nfs/dbraw/zinc/81/13/48/566811348.db2.gz PFCFMMOFIIMNHH-CQSZACIVSA-N 1 1 385.335 3.330 10 0 GGAEMO CCNS(=O)(=O)[C@H]1CC[N@H+](C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000517202231 566811451 /nfs/dbraw/zinc/81/14/51/566811451.db2.gz CGYFXABGASAHPI-OVHOFWQVSA-N 1 1 376.444 3.122 10 0 GGAEMO CCNS(=O)(=O)[C@H]1CC[N@@H+](C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000517202231 566811455 /nfs/dbraw/zinc/81/14/55/566811455.db2.gz CGYFXABGASAHPI-OVHOFWQVSA-N 1 1 376.444 3.122 10 0 GGAEMO CN(C)C(=O)C1([NH2+]Cc2nc3ccc(Br)cc3[nH]2)CCCCC1 ZINC000451411574 566813386 /nfs/dbraw/zinc/81/33/86/566813386.db2.gz MUPIWLBVSPAUGR-UHFFFAOYSA-N 1 1 379.302 3.206 10 0 GGAEMO C[C@H](C(=O)Nc1ccccc1Br)[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451410714 566814149 /nfs/dbraw/zinc/81/41/49/566814149.db2.gz CVGVZPOOHYTLAJ-DLTLXFJOSA-N 1 1 381.314 3.402 10 0 GGAEMO C[C@H](C(=O)Nc1ccccc1Br)[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451410714 566814155 /nfs/dbraw/zinc/81/41/55/566814155.db2.gz CVGVZPOOHYTLAJ-DLTLXFJOSA-N 1 1 381.314 3.402 10 0 GGAEMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1[C@@H]2Cc3cc(Br)ccc3[C@@H]21 ZINC000631676572 566814567 /nfs/dbraw/zinc/81/45/67/566814567.db2.gz AEKZKKNPKWZFRJ-XWCCPHMRSA-N 1 1 389.337 3.420 10 0 GGAEMO C[C@H](C(=O)Nc1ccccc1Br)[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451410716 566814526 /nfs/dbraw/zinc/81/45/26/566814526.db2.gz CVGVZPOOHYTLAJ-KFZJALRRSA-N 1 1 381.314 3.402 10 0 GGAEMO C[C@H](C(=O)Nc1ccccc1Br)[N@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451410716 566814528 /nfs/dbraw/zinc/81/45/28/566814528.db2.gz CVGVZPOOHYTLAJ-KFZJALRRSA-N 1 1 381.314 3.402 10 0 GGAEMO COCC[N@@H+](CCCc1ccc(Br)cc1OC)Cc1ccnn1C ZINC000489845388 566814572 /nfs/dbraw/zinc/81/45/72/566814572.db2.gz ORJZEYOUBGRJOY-UHFFFAOYSA-N 1 1 396.329 3.272 10 0 GGAEMO CC[C@@H]1C[N@@H+](C)CCCN1S(=O)(=O)Cc1cccc(Br)c1C ZINC000655580781 566816617 /nfs/dbraw/zinc/81/66/17/566816617.db2.gz FXLZFVYULQLNMD-OAHLLOKOSA-N 1 1 389.359 3.003 10 0 GGAEMO C[C@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl)[N@@H+]1CC[C@](O)(C(F)F)C1 ZINC000451432443 566817025 /nfs/dbraw/zinc/81/70/25/566817025.db2.gz FXEHIZKYUAFEPH-YNHOBRIKSA-N 1 1 381.250 3.261 10 0 GGAEMO C[C@H](C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl)[N@H+]1CC[C@](O)(C(F)F)C1 ZINC000451432443 566817029 /nfs/dbraw/zinc/81/70/29/566817029.db2.gz FXEHIZKYUAFEPH-YNHOBRIKSA-N 1 1 381.250 3.261 10 0 GGAEMO CCc1nn(C)cc1C[NH+]1CCN(Cc2ccc(Br)cc2)CC1 ZINC000678813554 566819259 /nfs/dbraw/zinc/81/92/59/566819259.db2.gz DEVSAOAQZMVERJ-UHFFFAOYSA-N 1 1 377.330 3.063 10 0 GGAEMO Cc1cc(OC[C@H](O)C[N@H+]2CC[C@@](O)(C(F)F)C2)c(C(C)C)cc1Cl ZINC000451440418 566819468 /nfs/dbraw/zinc/81/94/68/566819468.db2.gz PTIQFYSHBKHQGI-ACJLOTCBSA-N 1 1 377.859 3.213 10 0 GGAEMO O=C(NC[C@@H]1CSCC[N@@H+]1Cc1ccccc1)c1coc(Br)c1 ZINC000469873720 566823359 /nfs/dbraw/zinc/82/33/59/566823359.db2.gz SDZGJXBJKYMVIL-OAHLLOKOSA-N 1 1 395.322 3.390 10 0 GGAEMO O=C(NC[C@@H]1CSCC[N@H+]1Cc1ccccc1)c1coc(Br)c1 ZINC000469873720 566823363 /nfs/dbraw/zinc/82/33/63/566823363.db2.gz SDZGJXBJKYMVIL-OAHLLOKOSA-N 1 1 395.322 3.390 10 0 GGAEMO Clc1cc(Br)cc2c(N3CC[N@@H+]4CCOC[C@@H]4C3)ccnc12 ZINC000428189933 566823544 /nfs/dbraw/zinc/82/35/44/566823544.db2.gz ZIENIFTZHLGIHN-LBPRGKRZSA-N 1 1 382.689 3.172 10 0 GGAEMO Clc1cc(Br)cc2c(N3CC[N@H+]4CCOC[C@@H]4C3)ccnc12 ZINC000428189933 566823554 /nfs/dbraw/zinc/82/35/54/566823554.db2.gz ZIENIFTZHLGIHN-LBPRGKRZSA-N 1 1 382.689 3.172 10 0 GGAEMO O=C(NC[C@H]1CSCC[N@@H+]1Cc1ccccc1)c1coc(Br)c1 ZINC000469873719 566824173 /nfs/dbraw/zinc/82/41/73/566824173.db2.gz SDZGJXBJKYMVIL-HNNXBMFYSA-N 1 1 395.322 3.390 10 0 GGAEMO O=C(NC[C@H]1CSCC[N@H+]1Cc1ccccc1)c1coc(Br)c1 ZINC000469873719 566824179 /nfs/dbraw/zinc/82/41/79/566824179.db2.gz SDZGJXBJKYMVIL-HNNXBMFYSA-N 1 1 395.322 3.390 10 0 GGAEMO COCC[N@H+](Cc1cc(Br)ccc1OC(F)F)[C@H]1CCOC1 ZINC000490042415 566827329 /nfs/dbraw/zinc/82/73/29/566827329.db2.gz IUTAIDRWMWEIPW-ZDUSSCGKSA-N 1 1 380.229 3.288 10 0 GGAEMO COCC[N@@H+](Cc1cc(Br)ccc1OC(F)F)[C@H]1CCOC1 ZINC000490042415 566827333 /nfs/dbraw/zinc/82/73/33/566827333.db2.gz IUTAIDRWMWEIPW-ZDUSSCGKSA-N 1 1 380.229 3.288 10 0 GGAEMO Fc1ccc(CC[NH+]2CCN(c3ccc(Br)cn3)CC2)cc1F ZINC000490058008 566827903 /nfs/dbraw/zinc/82/79/03/566827903.db2.gz FEGAGDXOFQUQNR-UHFFFAOYSA-N 1 1 382.252 3.487 10 0 GGAEMO COCC[N@@H+](CCOc1ccc(Cl)cc1Br)[C@H]1CCOC1 ZINC000490059024 566827993 /nfs/dbraw/zinc/82/79/93/566827993.db2.gz VNMZBRPUDGNRRH-ZDUSSCGKSA-N 1 1 378.694 3.219 10 0 GGAEMO COc1ccc(Cl)cc1S(=O)(=O)N[C@H]1CC[N@H+](C)[C@H]1c1ccccc1 ZINC000582097824 566829836 /nfs/dbraw/zinc/82/98/36/566829836.db2.gz MVYPXJCRUCOUOH-YJBOKZPZSA-N 1 1 380.897 3.072 10 0 GGAEMO COc1ccc(Cl)cc1S(=O)(=O)N[C@H]1CC[N@@H+](C)[C@H]1c1ccccc1 ZINC000582097824 566829838 /nfs/dbraw/zinc/82/98/38/566829838.db2.gz MVYPXJCRUCOUOH-YJBOKZPZSA-N 1 1 380.897 3.072 10 0 GGAEMO COc1cc(Br)ccc1C[NH2+][C@H]1CCN(Cc2ccccc2)C1=O ZINC000542835938 566830180 /nfs/dbraw/zinc/83/01/80/566830180.db2.gz CUDQFYIZGNILMB-KRWDZBQOSA-N 1 1 389.293 3.348 10 0 GGAEMO COc1cc(Br)ccc1C[NH2+][C@@H]1CCN(Cc2ccccc2)C1=O ZINC000542835939 566831146 /nfs/dbraw/zinc/83/11/46/566831146.db2.gz CUDQFYIZGNILMB-QGZVFWFLSA-N 1 1 389.293 3.348 10 0 GGAEMO CC[C@@H](Cc1ccccc1Br)C(=O)N1CC[NH2+]C[C@@H]1C(F)F ZINC000582116819 566831215 /nfs/dbraw/zinc/83/12/15/566831215.db2.gz JUXYIFDACSVMOQ-SMDDNHRTSA-N 1 1 375.257 3.083 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)NC1(c2ccc(Cl)c(Cl)c2)CC1 ZINC000542841989 566831299 /nfs/dbraw/zinc/83/12/99/566831299.db2.gz PIYWYEYNJSFABE-CQSZACIVSA-N 1 1 386.323 3.393 10 0 GGAEMO CC(C)OCCC[NH+]1CCN(C(=O)COc2ccc(Cl)cc2Cl)CC1 ZINC000469986559 566833538 /nfs/dbraw/zinc/83/35/38/566833538.db2.gz BBWDMPQYCIDFER-UHFFFAOYSA-N 1 1 389.323 3.332 10 0 GGAEMO C[N@@H+](CC(=O)N1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1)[C@@H]1CCSC1 ZINC000490182810 566835439 /nfs/dbraw/zinc/83/54/39/566835439.db2.gz RKKSQORXZSHEKP-CZUORRHYSA-N 1 1 378.929 3.317 10 0 GGAEMO C[N@H+](CC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)[C@@H]1CCSC1 ZINC000490182810 566835443 /nfs/dbraw/zinc/83/54/43/566835443.db2.gz RKKSQORXZSHEKP-CZUORRHYSA-N 1 1 378.929 3.317 10 0 GGAEMO 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GGAEMO O=C(c1cc(Cl)cc(Br)c1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614096221 567084816 /nfs/dbraw/zinc/08/48/16/567084816.db2.gz XPSNPEHOZFHVRP-KBPBESRZSA-N 1 1 375.669 3.361 10 0 GGAEMO O=C(Cc1cc(Cl)ccc1Br)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614096208 567085095 /nfs/dbraw/zinc/08/50/95/567085095.db2.gz XMNIYRWLLJDQNX-CABCVRRESA-N 1 1 389.696 3.290 10 0 GGAEMO O=C(c1cc(Br)cc2cccnc21)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614091256 567085125 /nfs/dbraw/zinc/08/51/25/567085125.db2.gz DJZOUDGSDQYJLI-HOTGVXAUSA-N 1 1 392.272 3.256 10 0 GGAEMO O=C(CCOc1ccc(Cl)cc1Cl)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614102524 567085644 /nfs/dbraw/zinc/08/56/44/567085644.db2.gz PJBNKUDGQMRNTJ-GJZGRUSLSA-N 1 1 375.271 3.407 10 0 GGAEMO CC(C)Oc1cc(C(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)ccc1Br ZINC000614104891 567085728 /nfs/dbraw/zinc/08/57/28/567085728.db2.gz TXSOIGWFUKWGIZ-HOTGVXAUSA-N 1 1 399.304 3.495 10 0 GGAEMO O=C(CCOc1ccc(Cl)cc1Cl)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614102525 567085967 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3.251 10 0 GGAEMO Cc1ccc(O[C@H](C)C(=O)N2CC[C@@H]([NH+]3CCC3)[C@H](F)C2)c(Br)c1 ZINC000614105065 567086773 /nfs/dbraw/zinc/08/67/73/567086773.db2.gz ZQEZWUFQQBAOKS-FVQBIDKESA-N 1 1 399.304 3.170 10 0 GGAEMO CC(C)(Oc1ccc(Br)cc1)C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614103973 567086864 /nfs/dbraw/zinc/08/68/64/567086864.db2.gz OBFOHONVJICSLA-CVEARBPZSA-N 1 1 399.304 3.251 10 0 GGAEMO O=C(CCc1ccc(Br)cc1F)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614104104 567086924 /nfs/dbraw/zinc/08/69/24/567086924.db2.gz USETYMADLAFZCJ-JKSUJKDBSA-N 1 1 387.268 3.166 10 0 GGAEMO O=C(c1cc2c(cncc2Br)s1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614102429 567086976 /nfs/dbraw/zinc/08/69/76/567086976.db2.gz HDPOMTFAXPRCBF-CHWSQXEVSA-N 1 1 398.301 3.317 10 0 GGAEMO O=C([C@@H]1C[C@H]1c1ccc(Br)cc1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614107259 567087806 /nfs/dbraw/zinc/08/78/06/567087806.db2.gz RSUMKQJXOXLTQO-YVSFHVDLSA-N 1 1 381.289 3.197 10 0 GGAEMO Cn1ncc(C2CCC2)c1C[NH2+]Cc1cc2c(cc1Br)OCO2 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C[C@H](O)C[N@H+]1CCN(C(=O)N[C@@H]2CCc3c2ccc(Cl)c3Cl)[C@H](C)C1 ZINC000497479569 567100149 /nfs/dbraw/zinc/10/01/49/567100149.db2.gz QIIUPLHHBREGNV-BFQNTYOBSA-N 1 1 386.323 3.077 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)C(=O)Nc2ccc(Cl)cc2SC)[C@@H](C)C1 ZINC000657854600 567100320 /nfs/dbraw/zinc/10/03/20/567100320.db2.gz CXRMASQIHWIZBA-SWLSCSKDSA-N 1 1 383.945 3.189 10 0 GGAEMO OCC[N@@H+](Cc1cc(Br)cs1)Cc1ccccc1-n1cncn1 ZINC000683163904 567101497 /nfs/dbraw/zinc/10/14/97/567101497.db2.gz WGHDPRJVMRZVQV-UHFFFAOYSA-N 1 1 393.310 3.086 10 0 GGAEMO CC[C@@H]1C[N@@H+](C)CCCN1C(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000614332949 567103581 /nfs/dbraw/zinc/10/35/81/567103581.db2.gz WSRDEDRDYTZYKS-HUUCEWRRSA-N 1 1 381.314 3.258 10 0 GGAEMO Cc1ccc(NC(=O)c2c[nH+]ccc2N(C)C)cc1I ZINC000546078745 567103514 /nfs/dbraw/zinc/10/35/14/567103514.db2.gz AIAQHUAUJJFZKZ-UHFFFAOYSA-N 1 1 381.217 3.313 10 0 GGAEMO O=C(NCc1ccc(Cl)o1)NC[C@H]1CSCC[N@@H+]1Cc1ccccc1 ZINC000683199978 567103873 /nfs/dbraw/zinc/10/38/73/567103873.db2.gz DUPDFHPGUZGEEY-HNNXBMFYSA-N 1 1 379.913 3.350 10 0 GGAEMO O=C(NCc1ccc(Cl)o1)NC[C@H]1CSCC[N@H+]1Cc1ccccc1 ZINC000683199978 567103880 /nfs/dbraw/zinc/10/38/80/567103880.db2.gz DUPDFHPGUZGEEY-HNNXBMFYSA-N 1 1 379.913 3.350 10 0 GGAEMO O=C(N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1)N1CC[NH+](C2CC2)CC1 ZINC000473884041 567111593 /nfs/dbraw/zinc/11/15/93/567111593.db2.gz YUIZYEXMNMDSPF-CQSZACIVSA-N 1 1 383.323 3.062 10 0 GGAEMO C[C@@H](NC(=O)NCCCC[N@H+]1CCCC[C@H]1C)c1ncc(Br)cn1 ZINC000431857834 567112082 /nfs/dbraw/zinc/11/20/82/567112082.db2.gz ITFRQLPXBODIPG-ZIAGYGMSSA-N 1 1 398.349 3.254 10 0 GGAEMO CN(CC[N@@H+](C)C1CC1)C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000473902920 567112339 /nfs/dbraw/zinc/11/23/39/567112339.db2.gz DNOZNCUMLRRMSR-OAHLLOKOSA-N 1 1 382.302 3.008 10 0 GGAEMO Cc1cc(Br)cc(C)c1S(=O)(=O)N(C)C[C@H]1CCC[N@@H+](C)C1 ZINC000522373134 567113802 /nfs/dbraw/zinc/11/38/02/567113802.db2.gz JYPIYEDMDADBMU-AWEZNQCLSA-N 1 1 389.359 3.028 10 0 GGAEMO C[C@H](NC(=O)NCCCC[N@H+]1CCC[C@@H](C)C1)c1ncc(Br)cn1 ZINC000431864147 567113945 /nfs/dbraw/zinc/11/39/45/567113945.db2.gz INRKUAKMFJAJJK-KGLIPLIRSA-N 1 1 398.349 3.111 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)C(=O)NCC2=CCCCC2)cc1Br ZINC000453802955 567115069 /nfs/dbraw/zinc/11/50/69/567115069.db2.gz VYYOCTSMMPMTNG-UHFFFAOYSA-N 1 1 394.313 3.066 10 0 GGAEMO CCCC[N@H+]1CCCC[C@H]1CNC(=O)N[C@@H](C)c1ncc(Br)cn1 ZINC000431919224 567116611 /nfs/dbraw/zinc/11/66/11/567116611.db2.gz PCTPJAMUEGYIMT-ZFWWWQNUSA-N 1 1 398.349 3.254 10 0 GGAEMO CCCCSc1ccc(Cl)cc1C(=O)NC[C@@H]1C[N@H+]2CCN1CCC2 ZINC000614501422 567116952 /nfs/dbraw/zinc/11/69/52/567116952.db2.gz DUVCBNUUCMQFGE-MRXNPFEDSA-N 1 1 381.973 3.352 10 0 GGAEMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)NCCc2ccccc2Br)C1 ZINC000497691510 567118214 /nfs/dbraw/zinc/11/82/14/567118214.db2.gz PCXNEUXEVVACGP-RDJZCZTQSA-N 1 1 380.330 3.117 10 0 GGAEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccn(-c2ccc(Br)cc2)n1 ZINC000431995730 567120860 /nfs/dbraw/zinc/12/08/60/567120860.db2.gz OKTOITOHRQYSKX-AWEZNQCLSA-N 1 1 391.313 3.239 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccn(-c2ccc(Br)cc2)n1 ZINC000431995731 567121186 /nfs/dbraw/zinc/12/11/86/567121186.db2.gz OKTOITOHRQYSKX-CQSZACIVSA-N 1 1 391.313 3.239 10 0 GGAEMO CN(C(=O)c1ncc(Br)s1)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000683411804 567122263 /nfs/dbraw/zinc/12/22/63/567122263.db2.gz PQAOVBHMCMNGFE-ZDUSSCGKSA-N 1 1 380.311 3.252 10 0 GGAEMO C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+][C@H]1C[C@H](C)n2ncnc21 ZINC000658102373 567122204 /nfs/dbraw/zinc/12/22/04/567122204.db2.gz OSJCHSSXSKMWDV-SUNKGSAMSA-N 1 1 378.274 3.053 10 0 GGAEMO C[C@H](CC(=O)Nc1cccc(Br)c1)[NH2+][C@H]1C[C@@H](C)n2ncnc21 ZINC000658102371 567122423 /nfs/dbraw/zinc/12/24/23/567122423.db2.gz OSJCHSSXSKMWDV-GYSYKLTISA-N 1 1 378.274 3.053 10 0 GGAEMO C[C@H](CC(=O)Nc1ccc(Br)cc1)[NH2+][C@H]1C[C@@H](C)n2ncnc21 ZINC000658096009 567122443 /nfs/dbraw/zinc/12/24/43/567122443.db2.gz BCJRAXRTAYPXIF-GYSYKLTISA-N 1 1 378.274 3.053 10 0 GGAEMO C[C@H](NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1ccc(Br)cn1 ZINC000658141087 567124048 /nfs/dbraw/zinc/12/40/48/567124048.db2.gz WEWNCWNWZSWAHK-KSSFIOAISA-N 1 1 390.325 3.262 10 0 GGAEMO C[C@H](NCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1)c1ccc(Br)cn1 ZINC000658141087 567124058 /nfs/dbraw/zinc/12/40/58/567124058.db2.gz WEWNCWNWZSWAHK-KSSFIOAISA-N 1 1 390.325 3.262 10 0 GGAEMO C[C@H](NCc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1)c1ncc(Br)s1 ZINC000658136794 567124571 /nfs/dbraw/zinc/12/45/71/567124571.db2.gz IIUNHDLYOPEBOF-SWLSCSKDSA-N 1 1 396.354 3.323 10 0 GGAEMO COC(=O)C1([N@H+](C)C[C@@H](O)COc2c(Cl)cccc2Cl)CCCC1 ZINC000432030933 567125655 /nfs/dbraw/zinc/12/56/55/567125655.db2.gz IFXHIOHXVXUZSO-GFCCVEGCSA-N 1 1 376.280 3.151 10 0 GGAEMO COC(=O)C1([N@@H+](C)C[C@@H](O)COc2c(Cl)cccc2Cl)CCCC1 ZINC000432030933 567125664 /nfs/dbraw/zinc/12/56/64/567125664.db2.gz IFXHIOHXVXUZSO-GFCCVEGCSA-N 1 1 376.280 3.151 10 0 GGAEMO O=C(Cc1cscc1Br)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000432030864 567126191 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O=S(=O)(CC[NH2+][C@H]1CCOc2ccc(Br)cc21)c1ccccc1 ZINC000588691332 567133895 /nfs/dbraw/zinc/13/38/95/567133895.db2.gz LJRAOEWFLFOJSU-INIZCTEOSA-N 1 1 396.306 3.336 10 0 GGAEMO CCc1cccc(F)c1C[NH+]1CCC(NS(=O)(=O)c2cccs2)CC1 ZINC000474097285 567133860 /nfs/dbraw/zinc/13/38/60/567133860.db2.gz MTJQKFDFYZOJDF-UHFFFAOYSA-N 1 1 382.526 3.393 10 0 GGAEMO CC1=CC[N@@H+](CCNC(=O)NCCc2cc(Br)ccc2F)CC1 ZINC000546566072 567137313 /nfs/dbraw/zinc/13/73/13/567137313.db2.gz GBPGWKNDVMOAPX-UHFFFAOYSA-N 1 1 384.293 3.082 10 0 GGAEMO CC1=CC[N@@H+](CCNC(=O)Nc2ccc(I)cc2)CC1 ZINC000546575117 567140001 /nfs/dbraw/zinc/14/00/01/567140001.db2.gz IVHKFNRYCYFEFU-UHFFFAOYSA-N 1 1 385.249 3.065 10 0 GGAEMO C[C@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1ccc(OC(F)(F)F)c(Br)c1 ZINC000474150695 567140101 /nfs/dbraw/zinc/14/01/01/567140101.db2.gz BIRBOSIGSYACBZ-ONGXEEELSA-N 1 1 395.219 3.434 10 0 GGAEMO O[C@H](COC[C@H]1CCCO1)C[N@@H+]1CC=C(c2cccc(Br)c2)CC1 ZINC000546586395 567140727 /nfs/dbraw/zinc/14/07/27/567140727.db2.gz 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GGAEMO CN([C@@H]1CC[N@H+](Cc2ccccc2)C1)S(=O)(=O)c1ccc(Cl)cc1F ZINC000474317953 567159647 /nfs/dbraw/zinc/15/96/47/567159647.db2.gz XWEMXIPWWWORQL-MRXNPFEDSA-N 1 1 382.888 3.374 10 0 GGAEMO CN([C@@H]1CC[N@@H+](Cc2ccccc2)C1)S(=O)(=O)c1ccc(Cl)cc1F ZINC000474317953 567159654 /nfs/dbraw/zinc/15/96/54/567159654.db2.gz XWEMXIPWWWORQL-MRXNPFEDSA-N 1 1 382.888 3.374 10 0 GGAEMO CCN1C(=O)N=NC1C1CC[NH+](Cc2c(F)cccc2Br)CC1 ZINC000683896239 567160254 /nfs/dbraw/zinc/16/02/54/567160254.db2.gz SROIWUFHDUWFFI-UHFFFAOYSA-N 1 1 383.265 3.285 10 0 GGAEMO Cc1nc(C)c(C[N@H+]2CCC[C@@H](C(=O)Nc3ccc(Br)cn3)C2)o1 ZINC000683898292 567160306 /nfs/dbraw/zinc/16/03/06/567160306.db2.gz LVILUPZPHNVGJC-CYBMUJFWSA-N 1 1 393.285 3.300 10 0 GGAEMO CN(C)[C@H]1CCC[N@H+](CCCOc2cccc(I)c2)C1 ZINC000523611912 567163621 /nfs/dbraw/zinc/16/36/21/567163621.db2.gz FLTVDBCNZWDUHW-HNNXBMFYSA-N 1 1 388.293 3.086 10 0 GGAEMO CN(C)[C@H]1CCC[N@@H+](CCCOc2cccc(I)c2)C1 ZINC000523611912 567163627 /nfs/dbraw/zinc/16/36/27/567163627.db2.gz 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C[NH+](C)CC[C@@H](NC(=O)c1n[nH]c2ccc(Br)cc21)C(C)(C)C ZINC000523794152 567170831 /nfs/dbraw/zinc/17/08/31/567170831.db2.gz TXFWHJWAXZOJIF-CQSZACIVSA-N 1 1 381.318 3.422 10 0 GGAEMO C[N@H+]1CC[C@@H](NC(=O)c2cn3ccc(Br)cc3n2)[C@@H]1c1ccccc1 ZINC000566635556 567174299 /nfs/dbraw/zinc/17/42/99/567174299.db2.gz GREPLGCNHIULDW-QAPCUYQASA-N 1 1 399.292 3.272 10 0 GGAEMO Cc1ccc(C(=O)N2CCOC[C@@H]2[C@@H]2CCC[N@@H+]2C)c(C)c1Br ZINC000615270851 567175542 /nfs/dbraw/zinc/17/55/42/567175542.db2.gz SNRDJZIJAMTRBC-JKSUJKDBSA-N 1 1 381.314 3.001 10 0 GGAEMO C[N@H+]1CCC[C@@H]1[C@H]1COCCN1C(=O)c1ccc(Cl)c(C(F)(F)F)c1 ZINC000615271762 567175716 /nfs/dbraw/zinc/17/57/16/567175716.db2.gz YIHSJROWKYAHKR-HUUCEWRRSA-N 1 1 376.806 3.294 10 0 GGAEMO O=C([C@@H]1CCc2[nH]cnc2C1)N1CC[C@H](Cc2ccc(Br)cc2)C1 ZINC000615288461 567175792 /nfs/dbraw/zinc/17/57/92/567175792.db2.gz AKGXTSUARXYTOS-HUUCEWRRSA-N 1 1 388.309 3.368 10 0 GGAEMO CCC[C@H](C)[C@@H](CO)[NH2+]Cc1nc(Cc2cccc(Br)c2)no1 ZINC000566681558 567179963 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CC[N@H+]1C[C@H](C)N(C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C[C@H]1C ZINC000498567223 567186041 /nfs/dbraw/zinc/18/60/41/567186041.db2.gz MSCVLSJJTBSYIQ-NEPJUHHUSA-N 1 1 392.297 3.258 10 0 GGAEMO O=C(c1ccc(Br)cc1Cl)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000684185701 567186157 /nfs/dbraw/zinc/18/61/57/567186157.db2.gz LCDSNVWODOPNSB-KBPBESRZSA-N 1 1 375.669 3.361 10 0 GGAEMO COc1c(Br)c(C)sc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000684183162 567187020 /nfs/dbraw/zinc/18/70/20/567187020.db2.gz DFBNGVALPUPCBG-WDEREUQCSA-N 1 1 391.306 3.086 10 0 GGAEMO O=C(c1cc(Br)ccc1Cl)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000684185569 567187061 /nfs/dbraw/zinc/18/70/61/567187061.db2.gz YGYGROPKJFIVAS-ZIAGYGMSSA-N 1 1 375.669 3.361 10 0 GGAEMO COc1ccc(C[N@H+]2CCCC[C@@H]2CN2CCOCC2)c(Br)c1 ZINC000566764057 567187281 /nfs/dbraw/zinc/18/72/81/567187281.db2.gz BKAIIJSVAFNODR-MRXNPFEDSA-N 1 1 383.330 3.144 10 0 GGAEMO O=C(c1ccc(Br)cc1Cl)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000684185706 567187468 /nfs/dbraw/zinc/18/74/68/567187468.db2.gz LCDSNVWODOPNSB-UONOGXRCSA-N 1 1 375.669 3.361 10 0 GGAEMO O=C(c1cc(Br)ccc1Cl)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000684185568 567187547 /nfs/dbraw/zinc/18/75/47/567187547.db2.gz YGYGROPKJFIVAS-UONOGXRCSA-N 1 1 375.669 3.361 10 0 GGAEMO CC(C)(C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1)c1ccc(Br)cc1 ZINC000684184228 567187562 /nfs/dbraw/zinc/18/75/62/567187562.db2.gz GRGZUOUWJKZMNT-CVEARBPZSA-N 1 1 383.305 3.371 10 0 GGAEMO CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc(C)c(I)c2)C[C@H]1C ZINC000498570880 567188271 /nfs/dbraw/zinc/18/82/71/567188271.db2.gz HVZZHORZYGJVHJ-CHWSQXEVSA-N 1 1 386.277 3.154 10 0 GGAEMO CC[N@H+]1C[C@H](C)N(C(=O)c2ccc(C)c(I)c2)C[C@H]1C ZINC000498570881 567188612 /nfs/dbraw/zinc/18/86/12/567188612.db2.gz HVZZHORZYGJVHJ-OLZOCXBDSA-N 1 1 386.277 3.154 10 0 GGAEMO COC(=O)c1cccc(Br)c1C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000432776548 567190341 /nfs/dbraw/zinc/19/03/41/567190341.db2.gz PBVPFOJLGLHQAR-UONOGXRCSA-N 1 1 382.298 3.484 10 0 GGAEMO COc1c(Br)ccc(C)c1C(=O)N1CCC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000615602366 567193364 /nfs/dbraw/zinc/19/33/64/567193364.db2.gz BHTJCUFEQZAROT-SFHVURJKSA-N 1 1 381.314 3.324 10 0 GGAEMO C[C@H](CNC(=O)c1sc2c(c1Br)C[NH2+]C2)Oc1ccccc1F ZINC000659252021 567194484 /nfs/dbraw/zinc/19/44/84/567194484.db2.gz LTKDUYRZOAMLNN-SECBINFHSA-N 1 1 399.285 3.450 10 0 GGAEMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)C1(c3ccccc3Br)CC1)C2 ZINC000615601065 567194612 /nfs/dbraw/zinc/19/46/12/567194612.db2.gz HOJLHSHPBSYHRH-SFHVURJKSA-N 1 1 377.326 3.425 10 0 GGAEMO CC1(F)CN(C(=O)NC2CC[NH+](Cc3ccc(Br)cc3)CC2)C1 ZINC000684273043 567194782 /nfs/dbraw/zinc/19/47/82/567194782.db2.gz JTVZJQJJQQXZSO-UHFFFAOYSA-N 1 1 384.293 3.167 10 0 GGAEMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)Cc1c(F)ccc(Br)c1F)C2 ZINC000615606313 567194772 /nfs/dbraw/zinc/19/47/72/567194772.db2.gz WFPXEHOGLRUTPF-QGZVFWFLSA-N 1 1 387.268 3.214 10 0 GGAEMO COCc1cc(CNC(=O)c2sc3c(c2Br)C[NH2+]C3)ccc1F ZINC000659255550 567194880 /nfs/dbraw/zinc/19/48/80/567194880.db2.gz CTAOLSPUUHMGPH-UHFFFAOYSA-N 1 1 399.285 3.329 10 0 GGAEMO CC1=CC[N@@H+](CCNC(=O)NCCc2ccc(F)c(Br)c2)CC1 ZINC000547273399 567195190 /nfs/dbraw/zinc/19/51/90/567195190.db2.gz WAKJRPKCIRZQJL-UHFFFAOYSA-N 1 1 384.293 3.082 10 0 GGAEMO Ic1cccc2ncnc(N[C@H]3CC[N@H+]4CCCC[C@H]34)c12 ZINC000547277698 567195272 /nfs/dbraw/zinc/19/52/72/567195272.db2.gz WIYXPCRGILFDML-GXTWGEPZSA-N 1 1 394.260 3.273 10 0 GGAEMO COc1ccc(OC)c(CNC(=O)c2sc3c(c2Br)C[NH2+]C3)c1 ZINC000659261817 567195383 /nfs/dbraw/zinc/19/53/83/567195383.db2.gz GQZQYBDPHALNIW-UHFFFAOYSA-N 1 1 397.294 3.061 10 0 GGAEMO O=C(N[C@@H]1C[C@H]1Cc1ccccc1)c1sc2c(c1Br)C[NH2+]C2 ZINC000659267840 567196363 /nfs/dbraw/zinc/19/63/63/567196363.db2.gz DYKWPGSGAYNWAY-DGCLKSJQSA-N 1 1 377.307 3.475 10 0 GGAEMO CC(=O)N(C)c1ccccc1NC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659259238 567196458 /nfs/dbraw/zinc/19/64/58/567196458.db2.gz JEVZFECTXDVPPU-UHFFFAOYSA-N 1 1 394.294 3.349 10 0 GGAEMO Brc1cccc2c(N3CC[N@@H+]4CCOC[C@H]4C3)cc(C3CC3)nc12 ZINC000432837790 567196431 /nfs/dbraw/zinc/19/64/31/567196431.db2.gz WFLZPMCNJKBRHS-CQSZACIVSA-N 1 1 388.309 3.396 10 0 GGAEMO Brc1cccc2c(N3CC[N@H+]4CCOC[C@H]4C3)cc(C3CC3)nc12 ZINC000432837790 567196440 /nfs/dbraw/zinc/19/64/40/567196440.db2.gz WFLZPMCNJKBRHS-CQSZACIVSA-N 1 1 388.309 3.396 10 0 GGAEMO O=C(Nc1ccc2c(c1)NC(=O)CC2)c1sc2c(c1Br)C[NH2+]C2 ZINC000659259858 567196706 /nfs/dbraw/zinc/19/67/06/567196706.db2.gz RCYWCILHLSIQLB-UHFFFAOYSA-N 1 1 392.278 3.251 10 0 GGAEMO CC1(C)[C@H](NC(=O)c2sc3c(c2Br)C[NH2+]C3)[C@H]2CCCO[C@@H]21 ZINC000659268980 567196761 /nfs/dbraw/zinc/19/67/61/567196761.db2.gz VMGVHVLLUSMNHQ-WZYXQFPFSA-N 1 1 385.327 3.047 10 0 GGAEMO O=C(NCCCOc1ccccc1)c1sc2c(c1Br)C[NH2+]C2 ZINC000659268306 567196943 /nfs/dbraw/zinc/19/69/43/567196943.db2.gz MCLKTZAFHWFLNJ-UHFFFAOYSA-N 1 1 381.295 3.313 10 0 GGAEMO O=C(N[C@@H]1C[C@@H]1Cc1ccccc1)c1sc2c(c1Br)C[NH2+]C2 ZINC000659267841 567196954 /nfs/dbraw/zinc/19/69/54/567196954.db2.gz DYKWPGSGAYNWAY-WCQYABFASA-N 1 1 377.307 3.475 10 0 GGAEMO 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GGAEMO C/C(=C/c1cccc(C(F)(F)F)c1)C[N@H+]1CCC[C@@H](NS(C)(=O)=O)C1 ZINC000685410506 567270918 /nfs/dbraw/zinc/27/09/18/567270918.db2.gz IERBHSJDNHRJLH-RCBBPTIPSA-N 1 1 376.444 3.122 10 0 GGAEMO Brc1ccc(-c2nnc(C[N@@H+]3CCC[C@]4(CCCOC4)C3)o2)o1 ZINC000475743599 567271046 /nfs/dbraw/zinc/27/10/46/567271046.db2.gz IHIFGZVUYRWKDH-INIZCTEOSA-N 1 1 382.258 3.485 10 0 GGAEMO Brc1ccc(-c2nnc(C[N@H+]3CCC[C@]4(CCCOC4)C3)o2)o1 ZINC000475743599 567271055 /nfs/dbraw/zinc/27/10/55/567271055.db2.gz IHIFGZVUYRWKDH-INIZCTEOSA-N 1 1 382.258 3.485 10 0 GGAEMO NC(=O)C[C@@H]1CCCC[N@@H+]1Cc1cc(Br)cc(Br)c1 ZINC000685411421 567271358 /nfs/dbraw/zinc/27/13/58/567271358.db2.gz MFXHGETXRMJXCW-ZDUSSCGKSA-N 1 1 390.119 3.442 10 0 GGAEMO NC(=O)C[C@@H]1CCCC[N@H+]1Cc1cc(Br)cc(Br)c1 ZINC000685411421 567271363 /nfs/dbraw/zinc/27/13/63/567271363.db2.gz MFXHGETXRMJXCW-ZDUSSCGKSA-N 1 1 390.119 3.442 10 0 GGAEMO CN(C)c1nc(N2CCO[C@H](c3ccc(F)c(Br)c3)C2)cc[nH+]1 ZINC000475731426 567271671 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Cn1ncc2cc(C(=O)Nc3ccc(C[NH+](C)C)c(Br)c3)cnc21 ZINC000527285162 567326326 /nfs/dbraw/zinc/32/63/26/567326326.db2.gz MSCDLSGYEICNNU-UHFFFAOYSA-N 1 1 388.269 3.045 10 0 GGAEMO CC[C@H](CO)[NH+]1CCN(C(=O)Nc2cc(Cl)cc(Br)c2)CC1 ZINC000455967273 567326327 /nfs/dbraw/zinc/32/63/27/567326327.db2.gz HOMGYZFTJJEGNX-CQSZACIVSA-N 1 1 390.709 3.023 10 0 GGAEMO C[C@@H]1C[N@H+](CCCCNC(=O)c2csc(Br)c2)C[C@H](C)O1 ZINC000434775631 567328024 /nfs/dbraw/zinc/32/80/24/567328024.db2.gz KYKMVDQALAIFCL-TXEJJXNPSA-N 1 1 375.332 3.130 10 0 GGAEMO Brc1ccc(S[C@H]2CC[N@@H+](C[C@H]3CCc4ncnn43)C2)cc1 ZINC000639889492 567328152 /nfs/dbraw/zinc/32/81/52/567328152.db2.gz FPCIGEWKKWZQKT-HIFRSBDPSA-N 1 1 379.327 3.395 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)CCOCC(F)(F)F)cc1Br ZINC000527295965 567328321 /nfs/dbraw/zinc/32/83/21/567328321.db2.gz BMJBCPZDXLXMLO-UHFFFAOYSA-N 1 1 383.208 3.418 10 0 GGAEMO Brc1ccc(S[C@@H]2CC[N@@H+](C[C@H]3CCc4ncnn43)C2)cc1 ZINC000639889493 567328759 /nfs/dbraw/zinc/32/87/59/567328759.db2.gz 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ZINC000617700549 567330289 /nfs/dbraw/zinc/33/02/89/567330289.db2.gz GWADTHUVSFCMOY-OAHLLOKOSA-N 1 1 379.287 3.490 10 0 GGAEMO C[C@@H](CC(=O)NCC[N@@H+]1C[C@@H](C)OC[C@H]1C)c1ccc(Br)cc1 ZINC000617731410 567332340 /nfs/dbraw/zinc/33/23/40/567332340.db2.gz ZMNMLZBRGAYJGS-RRFJBIMHSA-N 1 1 383.330 3.168 10 0 GGAEMO C[C@@H](CC(=O)NCC[N@H+]1C[C@@H](C)OC[C@H]1C)c1ccc(Br)cc1 ZINC000617731410 567332348 /nfs/dbraw/zinc/33/23/48/567332348.db2.gz ZMNMLZBRGAYJGS-RRFJBIMHSA-N 1 1 383.330 3.168 10 0 GGAEMO Cc1nccc(NC(=O)NCCCC[N@@H+]2CCCC[C@@H]2C)c1Br ZINC000527339351 567332410 /nfs/dbraw/zinc/33/24/10/567332410.db2.gz DYHOOMWSGCVKOG-ZDUSSCGKSA-N 1 1 383.334 3.351 10 0 GGAEMO Cc1nccc(NC(=O)NCCCC[N@@H+]2CCCC[C@H]2C)c1Br ZINC000527339350 567332665 /nfs/dbraw/zinc/33/26/65/567332665.db2.gz DYHOOMWSGCVKOG-CYBMUJFWSA-N 1 1 383.334 3.351 10 0 GGAEMO C[N@@H+]1CCO[C@H](CSCC(=O)Nc2ccc(Br)cc2Cl)C1 ZINC000592360191 567332804 /nfs/dbraw/zinc/33/28/04/567332804.db2.gz OAAVPCXWEGJLER-NSHDSACASA-N 1 1 393.734 3.105 10 0 GGAEMO C[N@H+]1CCO[C@H](CSCC(=O)Nc2ccc(Br)cc2Cl)C1 ZINC000592360191 567332805 /nfs/dbraw/zinc/33/28/05/567332805.db2.gz OAAVPCXWEGJLER-NSHDSACASA-N 1 1 393.734 3.105 10 0 GGAEMO C[N@@H+](CCNS(=O)(=O)c1cc(Br)ccc1F)C1CCCCC1 ZINC000500601731 567333252 /nfs/dbraw/zinc/33/32/52/567333252.db2.gz MNLUMPFXXXMEBT-UHFFFAOYSA-N 1 1 393.322 3.131 10 0 GGAEMO CCO[C@@H]1C[C@H]([NH2+]Cc2c(F)ccc(Br)c2F)[C@H]1n1cccn1 ZINC000568524531 567335738 /nfs/dbraw/zinc/33/57/38/567335738.db2.gz VAAUEOFXTNWZDL-SQWLQELKSA-N 1 1 386.240 3.432 10 0 GGAEMO CCO[C@@H]1C[C@@H]([NH2+]Cc2c(F)ccc(Br)c2F)[C@@H]1n1cccn1 ZINC000568524527 567336462 /nfs/dbraw/zinc/33/64/62/567336462.db2.gz VAAUEOFXTNWZDL-FMKPAKJESA-N 1 1 386.240 3.432 10 0 GGAEMO C[C@H]1[C@H](NC(=O)c2ncsc2Br)CC[N@H+]1Cc1ccccc1 ZINC000568550892 567337375 /nfs/dbraw/zinc/33/73/75/567337375.db2.gz MVXVGQMAICUTCE-WCQYABFASA-N 1 1 380.311 3.298 10 0 GGAEMO Cc1nnc(CN(C)C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccc(Cl)cc2)s1 ZINC000660962873 567338738 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/nfs/dbraw/zinc/34/43/96/567344396.db2.gz RRLIEDKEFMGRQG-HOCLYGCPSA-N 1 1 376.551 3.121 10 0 GGAEMO C[C@H](CNC(=O)Cc1ccc(Br)cc1O)[N@@H+](C)Cc1ccccc1 ZINC000548730856 567344859 /nfs/dbraw/zinc/34/48/59/567344859.db2.gz NHZBZDZSXAHTDB-CQSZACIVSA-N 1 1 391.309 3.334 10 0 GGAEMO COc1cc(C[N@@H+]2CCO[C@]3(CCSC3)C2)ccc1OCC(F)(F)F ZINC000568629497 567345296 /nfs/dbraw/zinc/34/52/96/567345296.db2.gz HEXSSKNNZJKNBU-MRXNPFEDSA-N 1 1 377.428 3.344 10 0 GGAEMO COc1cc(C[N@H+]2CCO[C@]3(CCSC3)C2)ccc1OCC(F)(F)F ZINC000568629497 567345303 /nfs/dbraw/zinc/34/53/03/567345303.db2.gz HEXSSKNNZJKNBU-MRXNPFEDSA-N 1 1 377.428 3.344 10 0 GGAEMO CCN(C(=O)c1ccn(-c2ccc(Br)cc2)n1)[C@H]1CC[N@@H+](CC)C1 ZINC000617924259 567345946 /nfs/dbraw/zinc/34/59/46/567345946.db2.gz RBWFXRBHSRRMLS-INIZCTEOSA-N 1 1 391.313 3.191 10 0 GGAEMO CCN(C(=O)c1cnn(-c2ccc(Br)cc2)c1)[C@@H]1CC[N@@H+](CC)C1 ZINC000617931438 567346111 /nfs/dbraw/zinc/34/61/11/567346111.db2.gz XDEXBJVQTLDFBK-QGZVFWFLSA-N 1 1 391.313 3.191 10 0 GGAEMO CCN(C(=O)Cc1c[nH]c2cccc(Br)c12)[C@@H]1CC[N@@H+](CC)C1 ZINC000617927238 567346303 /nfs/dbraw/zinc/34/63/03/567346303.db2.gz SRXBBMOKISCPEX-CQSZACIVSA-N 1 1 378.314 3.416 10 0 GGAEMO CCN(C(=O)c1cc(Br)c(OC)c(OC)c1)[C@@H]1CC[N@@H+](CC)C1 ZINC000617923826 567346435 /nfs/dbraw/zinc/34/64/35/567346435.db2.gz JJMFKTYSBZKCQG-CYBMUJFWSA-N 1 1 385.302 3.023 10 0 GGAEMO C[C@@H]1C[C@H](NC(=O)N2CCc3ccc(F)c(Br)c3C2)CC[N@H+]1C ZINC000527594685 567346328 /nfs/dbraw/zinc/34/63/28/567346328.db2.gz QCZIGYCIUIUCOR-DGCLKSJQSA-N 1 1 384.293 3.139 10 0 GGAEMO C[C@@H](NC(=O)Cc1ccc(Br)cc1O)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000548733967 567346667 /nfs/dbraw/zinc/34/66/67/567346667.db2.gz DBKPENJKGMFPQP-HIFRSBDPSA-N 1 1 395.341 3.466 10 0 GGAEMO C[C@H](NC(=O)Cc1ccc(Br)cc1O)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000548733966 567346979 /nfs/dbraw/zinc/34/69/79/567346979.db2.gz DBKPENJKGMFPQP-DZGCQCFKSA-N 1 1 395.341 3.466 10 0 GGAEMO C[N@H+]1Cc2ccccc2[C@H](NC(=O)Cc2ccc(Br)cc2O)C1 ZINC000548734701 567347289 /nfs/dbraw/zinc/34/72/89/567347289.db2.gz RQNOABCOYDYZNE-MRXNPFEDSA-N 1 1 375.266 3.000 10 0 GGAEMO C[N@@H+]1Cc2ccccc2[C@H](NC(=O)Cc2ccc(Br)cc2O)C1 ZINC000548734701 567347294 /nfs/dbraw/zinc/34/72/94/567347294.db2.gz RQNOABCOYDYZNE-MRXNPFEDSA-N 1 1 375.266 3.000 10 0 GGAEMO Cc1nc2ccc(S(=O)(=O)N3CC[N@H+](C4CCC4)C[C@H](C)C3)cc2s1 ZINC000568706286 567349560 /nfs/dbraw/zinc/34/95/60/567349560.db2.gz OSFPQUSGOMGLQC-ZDUSSCGKSA-N 1 1 379.551 3.100 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000661127153 567349670 /nfs/dbraw/zinc/34/96/70/567349670.db2.gz IHLNJXLJROADHE-WFASDCNBSA-N 1 1 396.329 3.445 10 0 GGAEMO O=C(CCC[N@H+]1CC[C@@H](Cn2ccnn2)C1)c1ccc(Br)cc1 ZINC000661138963 567351007 /nfs/dbraw/zinc/35/10/07/567351007.db2.gz FXSGATUOWYSHMW-CQSZACIVSA-N 1 1 377.286 3.026 10 0 GGAEMO C[N@@H+]1CCN(C(=O)c2cc(Br)cc3nc[nH]c32)[C@H](c2ccccc2)C1 ZINC000548785872 567351148 /nfs/dbraw/zinc/35/11/48/567351148.db2.gz MIGSCFHVCNGPKH-KRWDZBQOSA-N 1 1 399.292 3.454 10 0 GGAEMO C[N@H+]1CCN(C(=O)c2cc(Br)cc3nc[nH]c32)[C@H](c2ccccc2)C1 ZINC000548785872 567351150 /nfs/dbraw/zinc/35/11/50/567351150.db2.gz MIGSCFHVCNGPKH-KRWDZBQOSA-N 1 1 399.292 3.454 10 0 GGAEMO C[C@H](O)C[N@@H+]1CCN(C(=O)c2cc(Br)cc3ccccc32)[C@@H](C)C1 ZINC000476844173 567352780 /nfs/dbraw/zinc/35/27/80/567352780.db2.gz DOPPYZDCZXLMNB-KBPBESRZSA-N 1 1 391.309 3.129 10 0 GGAEMO C[C@H](O)C[N@H+]1CCN(C(=O)c2cc(Br)cc3ccccc32)[C@@H](C)C1 ZINC000476844173 567352787 /nfs/dbraw/zinc/35/27/87/567352787.db2.gz DOPPYZDCZXLMNB-KBPBESRZSA-N 1 1 391.309 3.129 10 0 GGAEMO Brc1ccc(-c2cnc(C[N@H+]3CC[C@@H](Cn4ccnn4)C3)o2)cc1 ZINC000661145944 567353420 /nfs/dbraw/zinc/35/34/20/567353420.db2.gz WIKSRFRETDFCTJ-CYBMUJFWSA-N 1 1 388.269 3.218 10 0 GGAEMO Brc1ccc(-c2nc(C[N@H+]3CC[C@@H](Cn4ccnn4)C3)co2)cc1 ZINC000661142457 567353531 /nfs/dbraw/zinc/35/35/31/567353531.db2.gz BEQWNQSXPIGNQM-CYBMUJFWSA-N 1 1 388.269 3.218 10 0 GGAEMO Cc1cc(Br)cc2c(C(=O)N3CC[N@@H+](C[C@@H](C)O)C[C@H]3C)coc21 ZINC000476864462 567353985 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WCDOERKDKFUEKA-TZMCWYRMSA-N 1 1 376.444 3.065 10 0 GGAEMO C[C@@H]1C[N@@H+](CCC(=O)N2CCc3sccc3C2)C[C@@H](CC(F)(F)F)O1 ZINC000662245376 567421950 /nfs/dbraw/zinc/42/19/50/567421950.db2.gz WCDOERKDKFUEKA-TZMCWYRMSA-N 1 1 376.444 3.065 10 0 GGAEMO C[C@@H]1C[N@H+](CCC(=O)N2CCc3sccc3C2)C[C@H](CC(F)(F)F)O1 ZINC000662245375 567422120 /nfs/dbraw/zinc/42/21/20/567422120.db2.gz WCDOERKDKFUEKA-OCCSQVGLSA-N 1 1 376.444 3.065 10 0 GGAEMO C[C@@H]1C[N@@H+](CCC(=O)N2CCc3sccc3C2)C[C@H](CC(F)(F)F)O1 ZINC000662245375 567422124 /nfs/dbraw/zinc/42/21/24/567422124.db2.gz WCDOERKDKFUEKA-OCCSQVGLSA-N 1 1 376.444 3.065 10 0 GGAEMO CCC[N@H+]1CC[C@H](CNC(=O)N[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000618904139 567422184 /nfs/dbraw/zinc/42/21/84/567422184.db2.gz LUPZXQOSJPHHPQ-CJNGLKHVSA-N 1 1 396.329 3.304 10 0 GGAEMO COc1ccc(Br)cc1[C@@H]1CCCN1C[C@@H]1CCC2(C[NH2+]C2)O1 ZINC000662255204 567422808 /nfs/dbraw/zinc/42/28/08/567422808.db2.gz BCPVBNADHVJMPG-HOCLYGCPSA-N 1 1 381.314 3.116 10 0 GGAEMO Cc1cc(Br)c(C(=O)N[C@H]2CCC[N@H+](C)C2)cc1Br ZINC000528434891 567423299 /nfs/dbraw/zinc/42/32/99/567423299.db2.gz DJQHSAHLXYHMPL-JTQLQIEISA-N 1 1 390.119 3.344 10 0 GGAEMO Cc1cc(Br)c(C(=O)N[C@@H]2CCC[N@H+](C)C2)cc1Br ZINC000528434892 567423378 /nfs/dbraw/zinc/42/33/78/567423378.db2.gz DJQHSAHLXYHMPL-SNVBAGLBSA-N 1 1 390.119 3.344 10 0 GGAEMO C[N@@H+]1CCC[C@@H](NC(=O)c2scc(Br)c2Br)C1 ZINC000528434256 567423688 /nfs/dbraw/zinc/42/36/88/567423688.db2.gz AJOLYMZNQIJNPM-SSDOTTSWSA-N 1 1 382.121 3.097 10 0 GGAEMO C[N@H+]1CCC[C@@H](NC(=O)c2scc(Br)c2Br)C1 ZINC000528434256 567423691 /nfs/dbraw/zinc/42/36/91/567423691.db2.gz AJOLYMZNQIJNPM-SSDOTTSWSA-N 1 1 382.121 3.097 10 0 GGAEMO Brc1ccc2nc(C[N@@H+]3C[C@]45COC[C@@]4(C3)CCCC5)cn2c1 ZINC000662315021 567425699 /nfs/dbraw/zinc/42/56/99/567425699.db2.gz GHYDTISFAJUDCF-HDICACEKSA-N 1 1 376.298 3.489 10 0 GGAEMO O[C@@H](COc1ccc(Br)cc1)C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000662312795 567425961 /nfs/dbraw/zinc/42/59/61/567425961.db2.gz FEPRJYKMHKOKBF-QRQLOZEOSA-N 1 1 396.325 3.081 10 0 GGAEMO O=S(=O)(NC[C@@H]1CC[N@H+]1C1CCCCC1)c1ccccc1Br ZINC000528471355 567427125 /nfs/dbraw/zinc/42/71/25/567427125.db2.gz CEVPTWRDGMFXFE-AWEZNQCLSA-N 1 1 387.343 3.134 10 0 GGAEMO O=S(=O)(NC[C@@H]1CC[N@H+]1C1CCCCC1)C1CCC(C(F)(F)F)CC1 ZINC000528476913 567427211 /nfs/dbraw/zinc/42/72/11/567427211.db2.gz NOFQNQDDTYHCLX-SIWZUTFBSA-N 1 1 382.492 3.434 10 0 GGAEMO Brc1ccc(-c2nnc(C[N@@H+]3C[C@]45COC[C@@]4(C3)CCCC5)o2)o1 ZINC000662316266 567427388 /nfs/dbraw/zinc/42/73/88/567427388.db2.gz VOPGXRRHMRQYOF-CALCHBBNSA-N 1 1 394.269 3.485 10 0 GGAEMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1cnc2c(Br)cccn12 ZINC000436486922 567428191 /nfs/dbraw/zinc/42/81/91/567428191.db2.gz KFQISAMBLXAPPR-OLZOCXBDSA-N 1 1 392.301 3.187 10 0 GGAEMO COc1ccc(OC)c([C@H](C)NC(=O)[C@H]([NH3+])c2ccccc2Br)c1 ZINC000662352052 567428463 /nfs/dbraw/zinc/42/84/63/567428463.db2.gz RJOLGIUQWUDNAA-APPDUMDISA-N 1 1 393.281 3.344 10 0 GGAEMO C[C@H]1CCCC[N@H+]1CCCNC(=O)c1sc2c(c1Br)CNC2 ZINC000662350471 567428593 /nfs/dbraw/zinc/42/85/93/567428593.db2.gz BTRDYGXSUCOOTL-NSHDSACASA-N 1 1 386.359 3.108 10 0 GGAEMO Cc1[nH+]ccn1CCCN(C)C(=O)Nc1cnc2c(Br)cccn12 ZINC000436497131 567428722 /nfs/dbraw/zinc/42/87/22/567428722.db2.gz KSOIZFZHZYJPLU-UHFFFAOYSA-N 1 1 391.273 3.156 10 0 GGAEMO COc1ccc(OC)c([C@@H](C)NC(=O)[C@@H]([NH3+])c2ccccc2Br)c1 ZINC000662352053 567428770 /nfs/dbraw/zinc/42/87/70/567428770.db2.gz RJOLGIUQWUDNAA-DIFFPNOSSA-N 1 1 393.281 3.344 10 0 GGAEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc(Br)cc2O)[C@H]1c1ccccc1 ZINC000436524734 567431197 /nfs/dbraw/zinc/43/11/97/567431197.db2.gz KJKBJQGNVUORHO-NVXWUHKLSA-N 1 1 375.266 3.330 10 0 GGAEMO O=C([C@H]1COc2ccc(Br)cc21)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000457008409 567431517 /nfs/dbraw/zinc/43/15/17/567431517.db2.gz CKYZMFKSERYJAL-DLBZAZTESA-N 1 1 387.277 3.098 10 0 GGAEMO O=C(Cc1c(F)ccc(Br)c1F)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000457006402 567431613 /nfs/dbraw/zinc/43/16/13/567431613.db2.gz AQHXVUDOJLAWRM-MRXNPFEDSA-N 1 1 395.247 3.443 10 0 GGAEMO O=C(Cc1ccc(Br)c(F)c1)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000457007633 567431692 /nfs/dbraw/zinc/43/16/92/567431692.db2.gz BXVMIULHAPCCAF-QGZVFWFLSA-N 1 1 377.257 3.304 10 0 GGAEMO Fc1c(Br)ccc(CN2CCC[C@@H]([NH+]3CCOCC3)C2)c1F ZINC000528515945 567431873 /nfs/dbraw/zinc/43/18/73/567431873.db2.gz HGFLFHIPHXJEIE-CYBMUJFWSA-N 1 1 375.257 3.024 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CN(Cc1ccncc1)C(=O)[C@@H]1C[C@@]1(C)Br ZINC000528513160 567431972 /nfs/dbraw/zinc/43/19/72/567431972.db2.gz RLLZGHHBTSHWSJ-SOLBZPMBSA-N 1 1 380.330 3.068 10 0 GGAEMO O[C@H](COc1cc(F)ccc1Br)C[N@H+]1CCc2ccccc2C1 ZINC000550177509 567432100 /nfs/dbraw/zinc/43/21/00/567432100.db2.gz ZHXDDLDKZVFQCY-INIZCTEOSA-N 1 1 380.257 3.386 10 0 GGAEMO CN(C)c1cc(Br)cc(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC000457026748 567433042 /nfs/dbraw/zinc/43/30/42/567433042.db2.gz PKYGCXGIGYXELA-SFHVURJKSA-N 1 1 388.309 3.302 10 0 GGAEMO O=C(Cc1ccc(F)cc1Br)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000457027733 567433202 /nfs/dbraw/zinc/43/32/02/567433202.db2.gz PSOAAWZEYYLKRY-KRWDZBQOSA-N 1 1 377.257 3.304 10 0 GGAEMO CC[C@H](C)C(=O)N1CSC[C@H]1C(=O)Nc1ccc(C[NH+](C)C)c(Cl)c1 ZINC000478045334 567433796 /nfs/dbraw/zinc/43/37/96/567433796.db2.gz JPRGATRJNMBUNF-LRDDRELGSA-N 1 1 383.945 3.288 10 0 GGAEMO CC[C@@H](C)C(=O)N1CSC[C@@H]1C(=O)Nc1ccc(C[NH+](C)C)c(Cl)c1 ZINC000478045335 567433900 /nfs/dbraw/zinc/43/39/00/567433900.db2.gz JPRGATRJNMBUNF-MLGOLLRUSA-N 1 1 383.945 3.288 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(CCCc3ccc(Br)cc3OC)[C@H]2C1 ZINC000550216246 567434189 /nfs/dbraw/zinc/43/41/89/567434189.db2.gz SWWIQSYUFWBGIU-ZWKOTPCHSA-N 1 1 397.357 3.185 10 0 GGAEMO NC(=O)[C@]1(c2ccccc2)CC[N@H+](Cc2ccc(Br)c(F)c2F)C1 ZINC000528525690 567434411 /nfs/dbraw/zinc/43/44/11/567434411.db2.gz NJUDELNKPMNYFK-GOSISDBHSA-N 1 1 395.247 3.356 10 0 GGAEMO NC(=O)[C@]1(c2ccccc2)CC[N@@H+](Cc2ccc(Br)c(F)c2F)C1 ZINC000528525690 567434419 /nfs/dbraw/zinc/43/44/19/567434419.db2.gz NJUDELNKPMNYFK-GOSISDBHSA-N 1 1 395.247 3.356 10 0 GGAEMO O[C@@H]1C[C@@H]([C@H]2CCCOC2)[N@H+](Cc2ccc(Br)c(F)c2F)C1 ZINC000528517829 567434592 /nfs/dbraw/zinc/43/45/92/567434592.db2.gz PDERJZQIBGVVJR-SCRDCRAPSA-N 1 1 376.241 3.089 10 0 GGAEMO O[C@@H]1C[C@@H]([C@H]2CCCOC2)[N@@H+](Cc2ccc(Br)c(F)c2F)C1 ZINC000528517829 567434598 /nfs/dbraw/zinc/43/45/98/567434598.db2.gz PDERJZQIBGVVJR-SCRDCRAPSA-N 1 1 376.241 3.089 10 0 GGAEMO C[N@@H+](CCNC(=O)c1sc2c(c1Br)CNC2)C1CCCCC1 ZINC000662414897 567434700 /nfs/dbraw/zinc/43/47/00/567434700.db2.gz HFFRTNFWPSHICI-UHFFFAOYSA-N 1 1 386.359 3.108 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCCC[C@H]1c1ncc[nH]1 ZINC000662427580 567434905 /nfs/dbraw/zinc/43/49/05/567434905.db2.gz RFKQHTXSMGIQSN-JTQLQIEISA-N 1 1 381.299 3.204 10 0 GGAEMO O=C(NCCCOc1ccc(F)cc1)c1sc2c(c1Br)C[NH2+]C2 ZINC000662424670 567435104 /nfs/dbraw/zinc/43/51/04/567435104.db2.gz WWKFBMPYMJYWQH-UHFFFAOYSA-N 1 1 399.285 3.452 10 0 GGAEMO C[C@@H]1C[C@@H](S(=O)(=O)N[C@@H](C[NH+](C)C)c2ccc(Cl)c(Cl)c2)CCO1 ZINC000528548902 567435830 /nfs/dbraw/zinc/43/58/30/567435830.db2.gz RNKNLYWKPBIMQO-FFSVYQOJSA-N 1 1 395.352 3.083 10 0 GGAEMO Cc1noc(C)c1S(=O)(=O)N[C@@H](C[NH+](C)C)c1ccc(Cl)c(Cl)c1 ZINC000528550271 567436912 /nfs/dbraw/zinc/43/69/12/567436912.db2.gz UXHQVJNGXQFQDM-AWEZNQCLSA-N 1 1 392.308 3.179 10 0 GGAEMO C[NH+](C)C[C@H](NS(=O)(=O)c1ccccc1N)c1ccc(Cl)c(Cl)c1 ZINC000528552520 567437141 /nfs/dbraw/zinc/43/71/41/567437141.db2.gz ZTBUYZKZALZWDJ-HNNXBMFYSA-N 1 1 388.320 3.157 10 0 GGAEMO C[NH+]1CCN([C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccsc2)c2cccs2)CC1 ZINC000528553261 567437245 /nfs/dbraw/zinc/43/72/45/567437245.db2.gz RJEFRHYBRKHNRT-BBWFWOEESA-N 1 1 375.563 3.018 10 0 GGAEMO C[NH+](C)C[C@@H](NS(=O)(=O)c1ccc(N)cc1)c1ccc(Cl)c(Cl)c1 ZINC000528549117 567437371 /nfs/dbraw/zinc/43/73/71/567437371.db2.gz SDBSWLTXUSRHOY-MRXNPFEDSA-N 1 1 388.320 3.157 10 0 GGAEMO CC(C)[N@H+](C)C[C@@H](C)NC(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000641473599 567437421 /nfs/dbraw/zinc/43/74/21/567437421.db2.gz ZVPVCGPYINFBGB-IUODEOHRSA-N 1 1 384.318 3.301 10 0 GGAEMO C[NH+](C)C[C@H](NS(=O)(=O)c1cccc(N)c1)c1ccc(Cl)c(Cl)c1 ZINC000528550123 567437477 /nfs/dbraw/zinc/43/74/77/567437477.db2.gz UCFVRFIRONJPDD-INIZCTEOSA-N 1 1 388.320 3.157 10 0 GGAEMO Cc1ccc(I)c(C(=O)NCC[N@H+]2CCCC2(C)C)c1 ZINC000457081269 567437683 /nfs/dbraw/zinc/43/76/83/567437683.db2.gz VCWQYCPGVFYVBM-UHFFFAOYSA-N 1 1 386.277 3.204 10 0 GGAEMO O=S(=O)(NC[C@H]1CC[N@H+]1C1CCCC1)c1ccc(CC(F)(F)F)cc1 ZINC000528553087 567437664 /nfs/dbraw/zinc/43/76/64/567437664.db2.gz QPGIXCJDXMHEBD-OAHLLOKOSA-N 1 1 376.444 3.087 10 0 GGAEMO Cc1cc(Br)c(C(=O)NC[C@@H]2CCC[N@@H+]2C)cc1Br ZINC000528562244 567438416 /nfs/dbraw/zinc/43/84/16/567438416.db2.gz NGPBXHIIFBURNI-JTQLQIEISA-N 1 1 390.119 3.344 10 0 GGAEMO COc1cccc(C[C@@H](C)NC(=O)[C@H]([NH3+])c2ccccc2Br)c1 ZINC000662460410 567439695 /nfs/dbraw/zinc/43/96/95/567439695.db2.gz IQMZQWCUDYZKQL-SJKOYZFVSA-N 1 1 377.282 3.205 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)[C@H]3C[C@H]3c3cc(Cl)cc(Cl)c3)[C@H]2C1 ZINC000502516141 567439974 /nfs/dbraw/zinc/43/99/74/567439974.db2.gz JHMPMHOWRPNWOJ-XLAORIBOSA-N 1 1 383.319 3.419 10 0 GGAEMO COc1cccc(C[C@H](C)NC(=O)[C@H]([NH3+])c2ccccc2Br)c1 ZINC000662460412 567440037 /nfs/dbraw/zinc/44/00/37/567440037.db2.gz IQMZQWCUDYZKQL-YVEFUNNKSA-N 1 1 377.282 3.205 10 0 GGAEMO C[C@H]1C[N@H+](CCO)CCN1C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl ZINC000457099317 567440097 /nfs/dbraw/zinc/44/00/97/567440097.db2.gz MPRYNDUYPGOIBP-LBPRGKRZSA-N 1 1 382.291 3.127 10 0 GGAEMO C[C@H]1C[N@@H+](CCO)CCN1C(=O)c1[nH]ccc1-c1c(Cl)cccc1Cl ZINC000457099317 567440104 /nfs/dbraw/zinc/44/01/04/567440104.db2.gz MPRYNDUYPGOIBP-LBPRGKRZSA-N 1 1 382.291 3.127 10 0 GGAEMO Cc1c[nH+]cn1CC(=O)N1CCC[C@@H]1c1ccccc1I ZINC000528569223 567440239 /nfs/dbraw/zinc/44/02/39/567440239.db2.gz LZMFOFKULNFYBE-OAHLLOKOSA-N 1 1 395.244 3.160 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)CCCc3ccccc3Br)[C@H]2C1 ZINC000502539067 567441335 /nfs/dbraw/zinc/44/13/35/567441335.db2.gz IPBKFBGCGVKQCH-ZWKOTPCHSA-N 1 1 395.341 3.093 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCC[C@]2(CCCOC2)C1 ZINC000662488431 567441490 /nfs/dbraw/zinc/44/14/90/567441490.db2.gz VVPFUAJWZZKPTA-INIZCTEOSA-N 1 1 385.327 3.147 10 0 GGAEMO [NH3+][C@H](C(=O)N1CCO[C@@H](c2ccsc2)C1)c1ccccc1Br ZINC000662499524 567441685 /nfs/dbraw/zinc/44/16/85/567441685.db2.gz UOFVEDKHTRMLLF-CABCVRRESA-N 1 1 381.295 3.111 10 0 GGAEMO O=C(NCCC[C@@H]1CCCC[C@@H]1O)c1sc2c(c1Br)C[NH2+]C2 ZINC000662504289 567442577 /nfs/dbraw/zinc/44/25/77/567442577.db2.gz DKDNHSOCXVKXBS-JQWIXIFHSA-N 1 1 387.343 3.175 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)c3cccc(Br)c3Cl)[C@H]2C1 ZINC000502558617 567442806 /nfs/dbraw/zinc/44/28/06/567442806.db2.gz CKDWSNLKLZBCCW-UONOGXRCSA-N 1 1 387.705 3.038 10 0 GGAEMO COc1ccc(Br)c(C[N@H+]2CC3(CCOCC3)CC[C@@H]2CO)c1 ZINC000528646946 567444286 /nfs/dbraw/zinc/44/42/86/567444286.db2.gz YXMCFSMASQYDKS-OAHLLOKOSA-N 1 1 384.314 3.211 10 0 GGAEMO O=C(N[C@H]1C[C@]1(F)c1ccccc1)c1sc2c(c1Br)C[NH2+]C2 ZINC000662520568 567444590 /nfs/dbraw/zinc/44/45/90/567444590.db2.gz BSXJBCRATLCIMT-LRDDRELGSA-N 1 1 381.270 3.481 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc(Cl)cc3C(F)(F)F)[C@H]2C1 ZINC000502618579 567445375 /nfs/dbraw/zinc/44/53/75/567445375.db2.gz APYDTFCEHYDPKP-LSDHHAIUSA-N 1 1 376.806 3.294 10 0 GGAEMO Cc1nc2ccccn2c(=O)c1CC[N@H+](C)Cc1cccc(Br)c1 ZINC000569954661 567446046 /nfs/dbraw/zinc/44/60/46/567446046.db2.gz WVOOWRXIIMDDTR-UHFFFAOYSA-N 1 1 386.293 3.440 10 0 GGAEMO [NH3+][C@H](C(=O)NCc1nc2ccccc2n1C1CC1)c1ccccc1Br ZINC000662538258 567446014 /nfs/dbraw/zinc/44/60/14/567446014.db2.gz MKSQNMKWHRGSRZ-SFHVURJKSA-N 1 1 399.292 3.450 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCC[C@H](OCC2CC2)C1 ZINC000662534646 567446089 /nfs/dbraw/zinc/44/60/89/567446089.db2.gz MTPZDYGJVAGOOF-NSHDSACASA-N 1 1 385.327 3.145 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)CSc3cc(Cl)ccc3Cl)[C@H]2C1 ZINC000502659545 567446457 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CC[N@H+]1CC[C@H]2OCCN(C(=O)[C@@H]3C[C@@H]3c3ccc(Cl)c(Cl)c3)[C@H]2C1 ZINC000502738914 567448602 /nfs/dbraw/zinc/44/86/02/567448602.db2.gz QGOKNBPGFFYHIH-KJWYOANISA-N 1 1 383.319 3.419 10 0 GGAEMO C[N@@H+]1CC[C@H](NS(=O)(=O)c2ccc(Br)cc2)[C@@H]1c1ccccc1 ZINC000550490218 567449235 /nfs/dbraw/zinc/44/92/35/567449235.db2.gz DUFAWESFXFZZDS-IRXDYDNUSA-N 1 1 395.322 3.173 10 0 GGAEMO C[N@H+]1CC[C@H](NS(=O)(=O)c2ccc(Br)cc2)[C@@H]1c1ccccc1 ZINC000550490218 567449241 /nfs/dbraw/zinc/44/92/41/567449241.db2.gz DUFAWESFXFZZDS-IRXDYDNUSA-N 1 1 395.322 3.173 10 0 GGAEMO O=C(Cc1c(Cl)cccc1Br)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000662562512 567450003 /nfs/dbraw/zinc/45/00/03/567450003.db2.gz WGIFCYYRAIGOLS-INIZCTEOSA-N 1 1 394.700 3.213 10 0 GGAEMO C[N@@H+]1CC[C@@H](NS(=O)(=O)c2ccc(Br)cc2)[C@@H]1c1ccccc1 ZINC000550490219 567450052 /nfs/dbraw/zinc/45/00/52/567450052.db2.gz DUFAWESFXFZZDS-SJORKVTESA-N 1 1 395.322 3.173 10 0 GGAEMO C[N@H+]1CC[C@@H](NS(=O)(=O)c2ccc(Br)cc2)[C@@H]1c1ccccc1 ZINC000550490219 567450055 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CC(C)C[N@H+]1CCO[C@H](CNC(=O)CSCc2c(F)cccc2Cl)C1 ZINC000507793775 567705549 /nfs/dbraw/zinc/70/55/49/567705549.db2.gz NBLRHJPFRRPYDC-CQSZACIVSA-N 1 1 388.936 3.185 10 0 GGAEMO CN1CC[C@H]([NH2+]CCCNC(=O)c2ccc(Br)cc2)CC1(C)C ZINC000623396447 567707604 /nfs/dbraw/zinc/70/76/04/567707604.db2.gz SKAXCBAGHYHESP-INIZCTEOSA-N 1 1 382.346 3.031 10 0 GGAEMO CN(C(=O)NCCOCc1ccc(Cl)cc1Cl)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000554084530 567708654 /nfs/dbraw/zinc/70/86/54/567708654.db2.gz NLFYZTPHGQYQHR-MRXNPFEDSA-N 1 1 386.323 3.388 10 0 GGAEMO Fc1c(Br)ccc(C[NH2+]C2CCN(C[C@@H]3CCCO3)CC2)c1F ZINC000623418520 567708806 /nfs/dbraw/zinc/70/88/06/567708806.db2.gz UDXRYGWSTXVMEA-AWEZNQCLSA-N 1 1 389.284 3.460 10 0 GGAEMO CCc1ncc(S(=O)(=O)N[C@H](C)c2ccc(-n3cc[nH+]c3C)cc2)s1 ZINC000460916841 567709090 /nfs/dbraw/zinc/70/90/90/567709090.db2.gz YRINFMJBNMHLGL-GFCCVEGCSA-N 1 1 376.507 3.239 10 0 GGAEMO CN(C(=O)N[C@@H]1CCOc2c(Br)cccc21)[C@H]1CC[N@H+](C2CC2)C1 ZINC000507827308 567709567 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389.297 3.082 10 0 GGAEMO Cn1nccc1[C@H]1CCCC[N@H+]1C[C@@H](O)COc1ccc(Br)cc1 ZINC000532888128 567741355 /nfs/dbraw/zinc/74/13/55/567741355.db2.gz SNCKTWIHMNWGJZ-CRAIPNDOSA-N 1 1 394.313 3.150 10 0 GGAEMO C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)C2(c3cccc(Br)c3)CCCC2)C1 ZINC000646920988 567748268 /nfs/dbraw/zinc/74/82/68/567748268.db2.gz YIBYGSDHPRUTLX-YOEHRIQHSA-N 1 1 377.326 3.423 10 0 GGAEMO Cc1onc(-c2cccc(Br)c2)c1C(=O)N1CC[C@H]2C[N@H+](C)C[C@H]21 ZINC000646916512 567748387 /nfs/dbraw/zinc/74/83/87/567748387.db2.gz KCEMVDOBYPHGJA-DZGCQCFKSA-N 1 1 390.281 3.189 10 0 GGAEMO Cc1cc(C(=O)N2CC[C@H]3C[N@H+](C)C[C@H]32)nn1-c1ccc(Cl)c(Cl)c1 ZINC000646934952 567749203 /nfs/dbraw/zinc/74/92/03/567749203.db2.gz YDDYVJKEUQBRNV-YVEFUNNKSA-N 1 1 379.291 3.264 10 0 GGAEMO Cc1cc(C(=O)N2CC[C@@H]3C[N@H+](C)C[C@@H]32)nn1-c1ccc(Cl)c(Cl)c1 ZINC000646934949 567749714 /nfs/dbraw/zinc/74/97/14/567749714.db2.gz YDDYVJKEUQBRNV-PXAZEXFGSA-N 1 1 379.291 3.264 10 0 GGAEMO 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CC[N@H+]1CCc2nc(NC(=O)c3sc(C(C)(C)OC)nc3C)sc2C1 ZINC000554957840 567760059 /nfs/dbraw/zinc/76/00/59/567760059.db2.gz DKUQPPVWBBQBFC-UHFFFAOYSA-N 1 1 380.539 3.420 10 0 GGAEMO COc1ncc(Br)cc1C[NH2+][C@H]1CCN(C(C)=O)c2ccccc21 ZINC000624134165 567761801 /nfs/dbraw/zinc/76/18/01/567761801.db2.gz MMAZOUTWMNBJCA-INIZCTEOSA-N 1 1 390.281 3.440 10 0 GGAEMO COc1ncc(Br)cc1C[NH2+][C@@H]1CCN(C(C)=O)c2ccccc21 ZINC000624134166 567761808 /nfs/dbraw/zinc/76/18/08/567761808.db2.gz MMAZOUTWMNBJCA-MRXNPFEDSA-N 1 1 390.281 3.440 10 0 GGAEMO CN(C)C[C@H](NC1CC[NH+]([C@@H]2CCOC2)CC1)c1ccc(Cl)c(Cl)c1 ZINC000624192185 567766132 /nfs/dbraw/zinc/76/61/32/567766132.db2.gz NRDSTDAHPXTROD-APWZRJJASA-N 1 1 386.367 3.439 10 0 GGAEMO CCc1ccc(C[NH+]2CCN(CC(=O)Nc3ccc(Cl)cn3)CC2)s1 ZINC000533431371 567768903 /nfs/dbraw/zinc/76/89/03/567768903.db2.gz ZLJQUYUCDOFCKU-UHFFFAOYSA-N 1 1 378.929 3.115 10 0 GGAEMO Cc1[nH+]cc2n1C[C@H](C(=O)N1CCc3cc(Br)cc(C)c3C1)CC2 ZINC000574331145 567772749 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Cc1ccc(/C=C2/Sc3ccc(C(=O)N4CC[NH+](C)CC4)cc3NC2=O)cc1 ZINC000005035835 570402815 /nfs/dbraw/zinc/40/28/15/570402815.db2.gz WCZOXMKLJQLIEQ-DEDYPNTBSA-N 1 1 393.512 3.468 10 0 GGAEMO Cc1nc2cccnc2n1CC[NH+]1CCN(C(=O)Nc2cccc(Cl)c2)CC1 ZINC000033282005 570405621 /nfs/dbraw/zinc/40/56/21/570405621.db2.gz CSRZBXBJOLUZMI-UHFFFAOYSA-N 1 1 398.898 3.243 10 0 GGAEMO CC[NH+]1CCN(C(=O)CSc2nccnc2Sc2cccc(C)c2)CC1 ZINC000033289061 570405885 /nfs/dbraw/zinc/40/58/85/570405885.db2.gz MBBJVDGHSWFMKN-UHFFFAOYSA-N 1 1 388.562 3.192 10 0 GGAEMO CC[NH+]1CCN(C(=O)CSc2nccnc2Sc2ccccc2C)CC1 ZINC000033288987 570405952 /nfs/dbraw/zinc/40/59/52/570405952.db2.gz ZNBZZUJTRDJOFM-UHFFFAOYSA-N 1 1 388.562 3.192 10 0 GGAEMO C[N@@H+](Cc1nc2ccccc2s1)C[C@@H](O)COCc1ccc2c(c1)OCO2 ZINC000025233278 570409035 /nfs/dbraw/zinc/40/90/35/570409035.db2.gz SJZDONQQOVLVIO-OAHLLOKOSA-N 1 1 386.473 3.035 10 0 GGAEMO C[N@H+](Cc1nc2ccccc2s1)C[C@@H](O)COCc1ccc2c(c1)OCO2 ZINC000025233278 570409038 /nfs/dbraw/zinc/40/90/38/570409038.db2.gz SJZDONQQOVLVIO-OAHLLOKOSA-N 1 1 386.473 3.035 10 0 GGAEMO CCCC[N@@H+](CC)CCCNC(=O)COc1cc(=O)n(CC)c2ccccc12 ZINC000005067435 570410423 /nfs/dbraw/zinc/41/04/23/570410423.db2.gz BNMFBUSGUMQPKU-UHFFFAOYSA-N 1 1 387.524 3.029 10 0 GGAEMO CC(C)[N@@H+](CCCNC(=O)C[C@@H]1Oc2ccccc2NC1=O)Cc1ccccc1 ZINC000005069602 570410853 /nfs/dbraw/zinc/41/08/53/570410853.db2.gz XEXXLGDJCSYBFT-NRFANRHFSA-N 1 1 395.503 3.193 10 0 aggregator GGAEMO CC(=O)N1CCc2cc(NC(=O)C[N@H+]3CCC[C@@H]3Cc3ccccc3)ccc21 ZINC000025440870 570413745 /nfs/dbraw/zinc/41/37/45/570413745.db2.gz ACKOPODLEWKYPX-OAQYLSRUSA-N 1 1 377.488 3.241 10 0 GGAEMO CC(=O)N1CCc2cc(NC(=O)C[N@H+]3CCC[C@H]3Cc3ccccc3)ccc21 ZINC000025440872 570413754 /nfs/dbraw/zinc/41/37/54/570413754.db2.gz ACKOPODLEWKYPX-NRFANRHFSA-N 1 1 377.488 3.241 10 0 GGAEMO C[C@H](C(=O)N[C@@H](C)c1ccccc1)[NH+]1CCC(NC(=O)c2ccccc2)CC1 ZINC000025826806 570420153 /nfs/dbraw/zinc/42/01/53/570420153.db2.gz VSPPHXWWUSSTPD-ZWKOTPCHSA-N 1 1 379.504 3.147 10 0 GGAEMO CC[S@](=O)[C@@H]1CCC[C@@H](NC(=O)N[C@H]2CCC[N@H+](C3CCCCC3)C2)C1 ZINC000241965694 570432195 /nfs/dbraw/zinc/43/21/95/570432195.db2.gz UVALKUHHBLZHRP-QAZPSSTNSA-N 1 1 383.602 3.163 10 0 GGAEMO COc1cccc(N2C(=O)CN([C@H]3CC[N@@H+](Cc4ccccc4)C3)C[C@H]2C)c1 ZINC000244708239 570433129 /nfs/dbraw/zinc/43/31/29/570433129.db2.gz KPXXDRXWXMBHBQ-NQIIRXRSSA-N 1 1 379.504 3.007 10 0 GGAEMO CCNC(=O)C1CC[NH+](Cc2nc(-c3cccc(C(F)(F)F)c3)no2)CC1 ZINC000027416210 570434521 /nfs/dbraw/zinc/43/45/21/570434521.db2.gz WAPSLERDZMOUNN-UHFFFAOYSA-N 1 1 382.386 3.104 10 0 GGAEMO O=C([C@@H]1CCN(c2cc(Cl)ccc2Cl)C1=O)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000248002568 570434852 /nfs/dbraw/zinc/43/48/52/570434852.db2.gz RKFPLJBINYJPPP-GJZGRUSLSA-N 1 1 396.318 3.043 10 0 GGAEMO CC(C)(C)NC(=O)C[N@@H+]1CCCN(Cc2csc(-c3ccccc3)n2)CC1 ZINC000029195748 570470068 /nfs/dbraw/zinc/47/00/68/570470068.db2.gz XNXYVWCYLHKALL-UHFFFAOYSA-N 1 1 386.565 3.233 10 0 GGAEMO CC(C)(C)NC(=O)C[N@H+]1CCCN(Cc2csc(-c3ccccc3)n2)CC1 ZINC000029195748 570470070 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385.489 3.083 10 0 GGAEMO C[C@H](O)C[N@H+]1CCN(C(=O)c2ccc(-c3nc4ccccc4s3)o2)C[C@H]1C ZINC000246874363 570485395 /nfs/dbraw/zinc/48/53/95/570485395.db2.gz WFYZXEHTNOWYHY-KGLIPLIRSA-N 1 1 385.489 3.083 10 0 GGAEMO O=C(NCCC[NH+]1CCOCC1)c1ccc(-c2cc(-c3ccccc3)n[nH]2)cc1 ZINC000022666865 570492896 /nfs/dbraw/zinc/49/28/96/570492896.db2.gz JATPMGCJJBUSFA-UHFFFAOYSA-N 1 1 390.487 3.196 10 0 GGAEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCCNC(=O)Cn1ncc2c1-c1ccccc1OC2 ZINC000006805371 570493950 /nfs/dbraw/zinc/49/39/50/570493950.db2.gz AZNHNWXCGOEHBX-CALCHBBNSA-N 1 1 382.508 3.212 10 0 GGAEMO CCOC(=O)C1=C(C[NH+]2CCCCC2)N(CC)C(=O)N[C@H]1c1ccccc1F ZINC000035991078 570505415 /nfs/dbraw/zinc/50/54/15/570505415.db2.gz ZCOVEUDNMIXHAD-IBGZPJMESA-N 1 1 389.471 3.215 10 0 GGAEMO CCOC(=O)C1=C(C[NH+]2CCCCC2)N(CC)C(=O)N[C@@H]1c1cccc(F)c1 ZINC000035991639 570505761 /nfs/dbraw/zinc/50/57/61/570505761.db2.gz WRSFWFZNAXFQFD-LJQANCHMSA-N 1 1 389.471 3.215 10 0 GGAEMO Cc1cccc(NCCNS(=O)(=O)c2csc(-c3ccc(F)cc3)n2)[nH+]1 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COCCC[N@H+](Cc1ccc(C)s1)C[C@@H](O)COc1ccc(OC)cc1 ZINC000036101420 570538450 /nfs/dbraw/zinc/53/84/50/570538450.db2.gz SLMKTNRWWMLMJQ-QGZVFWFLSA-N 1 1 379.522 3.344 10 0 GGAEMO CCn1nnc2cc(C(=O)N3c4ccc(C)cc4[C@H]4C[N@H+](C)CC[C@H]43)ccc21 ZINC000008745146 570539894 /nfs/dbraw/zinc/53/98/94/570539894.db2.gz IPAIELBNOFVNEU-YLJYHZDGSA-N 1 1 375.476 3.208 10 0 GGAEMO COc1cccc(C[N@@H+](Cc2ccco2)C[C@@H](O)COCC(C)C)c1OC ZINC000036103605 570540371 /nfs/dbraw/zinc/54/03/71/570540371.db2.gz FTKMGYBUQOVDNG-GOSISDBHSA-N 1 1 377.481 3.333 10 0 GGAEMO COc1cccc(C[N@H+](Cc2ccco2)C[C@@H](O)COCC(C)C)c1OC ZINC000036103605 570540375 /nfs/dbraw/zinc/54/03/75/570540375.db2.gz FTKMGYBUQOVDNG-GOSISDBHSA-N 1 1 377.481 3.333 10 0 GGAEMO COC(=O)c1cccc(OC[C@@H](O)C[N@@H+](C)[C@H](C)c2ccc(F)c(F)c2)c1 ZINC000034887447 570546233 /nfs/dbraw/zinc/54/62/33/570546233.db2.gz OQRDPNFIUUEVEG-CJNGLKHVSA-N 1 1 379.403 3.184 10 0 GGAEMO CC[N@@H+](Cc1nc(=O)c2c3c(sc2[nH]1)CCCC3)C[C@@H](O)Cc1ccccc1 ZINC000036160889 570555801 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CCCN(C)C(=O)[C@@H](C1CCCC1)[NH+]1CCN(C(=O)CCc2ccccc2)CC1 ZINC000036250700 570587560 /nfs/dbraw/zinc/58/75/60/570587560.db2.gz SWLQMNIUOFZHAP-HSZRJFAPSA-N 1 1 399.579 3.191 10 0 GGAEMO CC(C)CC(=O)N1CC[NH+]([C@H](C(=O)N(C)Cc2ccccc2)C2CCCC2)CC1 ZINC000036250671 570587617 /nfs/dbraw/zinc/58/76/17/570587617.db2.gz QPSNKXUZPHFBNH-QHCPKHFHSA-N 1 1 399.579 3.394 10 0 GGAEMO COCC[N@@H+]1CCC[C@@H]1CN[C@H](C)c1cnccc1NC(=O)OC(C)(C)C ZINC000225565773 570588912 /nfs/dbraw/zinc/58/89/12/570588912.db2.gz PFOPCHLPKUBFQB-HZPDHXFCSA-N 1 1 378.517 3.190 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CN[C@H](C)c1cnccc1NC(=O)OC(C)(C)C ZINC000225565773 570588916 /nfs/dbraw/zinc/58/89/16/570588916.db2.gz PFOPCHLPKUBFQB-HZPDHXFCSA-N 1 1 378.517 3.190 10 0 GGAEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCCNC(=O)Cn1c2ccccc2n2cccc2c1=O ZINC000006782351 570589457 /nfs/dbraw/zinc/58/94/57/570589457.db2.gz FNQCPOCEBGFRGM-HDICACEKSA-N 1 1 394.519 3.023 10 0 GGAEMO O[C@H](Cc1ccccc1)C[N@@H+]1CCO[C@@H](COc2cccc(C(F)(F)F)c2)C1 ZINC000169679848 570601182 /nfs/dbraw/zinc/60/11/82/570601182.db2.gz OMUPLIUWOCSMJT-UYAOXDASSA-N 1 1 395.421 3.389 10 0 GGAEMO O[C@H](Cc1ccccc1)C[N@H+]1CCO[C@@H](COc2cccc(C(F)(F)F)c2)C1 ZINC000169679848 570601186 /nfs/dbraw/zinc/60/11/86/570601186.db2.gz OMUPLIUWOCSMJT-UYAOXDASSA-N 1 1 395.421 3.389 10 0 GGAEMO O=C(Nc1ccccc1)N1CC[NH+]([C@H](C(=O)N2CCCC2)C2CCCC2)CC1 ZINC000036310680 570609349 /nfs/dbraw/zinc/60/93/49/570609349.db2.gz GLHJUVASCSUQDH-FQEVSTJZSA-N 1 1 384.524 3.017 10 0 GGAEMO CCCN(Cc1c(-c2ccc(F)cc2)noc1N1CC[NH+](C)CC1)C(=O)CC ZINC000036312195 570610458 /nfs/dbraw/zinc/61/04/58/570610458.db2.gz LEDKPBZVKLRZMO-UHFFFAOYSA-N 1 1 388.487 3.381 10 0 GGAEMO O=C(NCCC[NH+]1CCOCC1)c1ccc2nc(CCc3ccccc3)oc2c1 ZINC000064968064 570619004 /nfs/dbraw/zinc/61/90/04/570619004.db2.gz LSQWNPQJIAYDEY-UHFFFAOYSA-N 1 1 393.487 3.065 10 0 GGAEMO Cc1cc2nc(C)c(=O)n(CCC(=O)NCCC[N@@H+]3CCCC[C@H]3C)c2cc1C ZINC000033005670 570618975 /nfs/dbraw/zinc/61/89/75/570618975.db2.gz KNMMZKWIFSNFST-GOSISDBHSA-N 1 1 398.551 3.093 10 0 GGAEMO Cc1ccc([C@H]2CC(c3cccc(F)c3)=NN2C(=O)CN2CC[NH+](C)CC2)cc1 ZINC000036343697 570626380 /nfs/dbraw/zinc/62/63/80/570626380.db2.gz PESJQKYERWMAHK-JOCHJYFZSA-N 1 1 394.494 3.059 10 0 GGAEMO Cc1ccccc1[C@H]1CC(c2ccc(F)cc2)=NN1C(=O)CN1CC[NH+](C)CC1 ZINC000036344870 570627070 /nfs/dbraw/zinc/62/70/70/570627070.db2.gz ZRWGQVNDGZCDEF-JOCHJYFZSA-N 1 1 394.494 3.059 10 0 GGAEMO Cc1cccc(C2=NN(C(=O)CN3CC[NH+](C)CC3)[C@H](c3ccccc3F)C2)c1 ZINC000036345463 570627507 /nfs/dbraw/zinc/62/75/07/570627507.db2.gz IHXTXEZHVXQAPL-QFIPXVFZSA-N 1 1 394.494 3.059 10 0 GGAEMO Cc1cccc(N2CCN(C(=O)Nc3ccc(N4CCCC4=O)cc3)[C@H](C)C2)[nH+]1 ZINC000072313548 570651866 /nfs/dbraw/zinc/65/18/66/570651866.db2.gz WOSMFENPTFYCSH-QGZVFWFLSA-N 1 1 393.491 3.259 10 0 GGAEMO Cc1cccnc1NC(=O)[C@@H]1CCC[N@@H+](C[C@@H](O)c2ccc(F)c(F)c2)C1 ZINC000229750264 570666106 /nfs/dbraw/zinc/66/61/06/570666106.db2.gz BEIQDRWUQSYACO-CRAIPNDOSA-N 1 1 375.419 3.052 10 0 GGAEMO O=C([C@H]1Cc2ccccc2C[N@H+]1C[C@@H](O)c1ccccc1Cl)N1CCCC1 ZINC000229745212 570666467 /nfs/dbraw/zinc/66/64/67/570666467.db2.gz GPTYWUMJWKPFQO-NHCUHLMSSA-N 1 1 384.907 3.423 10 0 GGAEMO O=C([C@H]1Cc2ccccc2C[N@@H+]1C[C@@H](O)c1ccccc1Cl)N1CCCC1 ZINC000229745212 570666468 /nfs/dbraw/zinc/66/64/68/570666468.db2.gz GPTYWUMJWKPFQO-NHCUHLMSSA-N 1 1 384.907 3.423 10 0 GGAEMO CC(C)CCn1ncc(C(=O)NCC2CCN(CC[NH+](C)C)CC2)c1C(C)C ZINC000239882299 570684522 /nfs/dbraw/zinc/68/45/22/570684522.db2.gz DAZOQEIYTOICJK-UHFFFAOYSA-N 1 1 391.604 3.056 10 0 GGAEMO COCCC[N@@H+](Cc1cncnc1)[C@H]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000241316816 570686540 /nfs/dbraw/zinc/68/65/40/570686540.db2.gz LVCXVFSXASMGDI-SFHVURJKSA-N 1 1 378.517 3.105 10 0 GGAEMO Cc1cnc(C(=O)NC2CC[NH+](Cc3cccc(C(F)(F)F)c3)CC2)cn1 ZINC000057991194 570705403 /nfs/dbraw/zinc/70/54/03/570705403.db2.gz XVNNEFNSAAVMRC-UHFFFAOYSA-N 1 1 378.398 3.198 10 0 GGAEMO CCCCc1noc([C@H](C)N2CC[NH+](CCOc3ccc(OC)cc3)CC2)n1 ZINC000058010560 570706822 /nfs/dbraw/zinc/70/68/22/570706822.db2.gz SWJGUHQLRWEPBN-KRWDZBQOSA-N 1 1 388.512 3.178 10 0 GGAEMO CCOC(=O)[C@@H]1C[C@H]2CCC[N@H+]2[C@@]12c1ccccc1N(Cc1ccccc1)C2=O ZINC000058090325 570708725 /nfs/dbraw/zinc/70/87/25/570708725.db2.gz JSPQCGNBGKHZMJ-WWEVIYMKSA-N 1 1 390.483 3.476 10 0 GGAEMO CCOC(=O)C1=C(C[N@H+](C)Cc2ccccc2C)NC(=O)N[C@H]1c1cccs1 ZINC000058122849 570709895 /nfs/dbraw/zinc/70/98/95/570709895.db2.gz XWUNLZIEODKUPZ-IBGZPJMESA-N 1 1 399.516 3.360 10 0 GGAEMO CCOC(=O)C1=C(C[N@@H+](C)Cc2ccccc2C)NC(=O)N[C@H]1c1cccs1 ZINC000058122849 570709899 /nfs/dbraw/zinc/70/98/99/570709899.db2.gz XWUNLZIEODKUPZ-IBGZPJMESA-N 1 1 399.516 3.360 10 0 GGAEMO Cn1c2ccccc2c(C(=O)C[NH+]2CCC(C(N)=O)CC2)c1-c1ccccc1 ZINC000058135495 570710408 /nfs/dbraw/zinc/71/04/08/570710408.db2.gz VZTKHKHIGMHDOQ-UHFFFAOYSA-N 1 1 375.472 3.225 10 0 GGAEMO C[C@H](c1cccc(NC(=O)c2ccccc2)c1)[N@H+](C)CC(=O)N1CCO[C@@H](C)C1 ZINC000036447056 570711883 /nfs/dbraw/zinc/71/18/83/570711883.db2.gz PSJSCYGFLQWQMV-ZWKOTPCHSA-N 1 1 395.503 3.179 10 0 GGAEMO 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/nfs/dbraw/zinc/23/96/16/1434239616.db2.gz BVQJBKVQKKDGQT-KRWDZBQOSA-N 1 1 380.492 3.127 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)Nc1cccc(C(=O)N(C)C)c1 ZINC000265494679 1434239618 /nfs/dbraw/zinc/23/96/18/1434239618.db2.gz BVQJBKVQKKDGQT-KRWDZBQOSA-N 1 1 380.492 3.127 10 0 GGAEMO CN1CC[NH+](CCOc2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccc(F)cc3)cc2)CC1 ZINC000266297142 1434317444 /nfs/dbraw/zinc/31/74/44/1434317444.db2.gz HROKCSHQNOSNSP-FGZHOGPDSA-N 1 1 397.494 3.194 10 0 GGAEMO Cc1ccn2cc(CNC(=O)N(C)C[C@H]3CC[N@@H+](Cc4ccccc4)C3)nc2c1 ZINC000266467254 1434340614 /nfs/dbraw/zinc/34/06/14/1434340614.db2.gz FMGXDSGQHNCFSX-HXUWFJFHSA-N 1 1 391.519 3.306 10 0 GGAEMO CC(=O)N(C)c1cccc(NC(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000267550694 1434445319 /nfs/dbraw/zinc/44/53/19/1434445319.db2.gz CVBDGBXVRDACPR-KRWDZBQOSA-N 1 1 380.492 3.408 10 0 GGAEMO CC(=O)N(C)c1cccc(NC(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C)c1 ZINC000267550694 1434445322 /nfs/dbraw/zinc/44/53/22/1434445322.db2.gz CVBDGBXVRDACPR-KRWDZBQOSA-N 1 1 380.492 3.408 10 0 GGAEMO CC[N@H+](Cc1ccc2c(c1)OCO2)[C@@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000270673202 1434759953 /nfs/dbraw/zinc/75/99/53/1434759953.db2.gz ATFNQQHDXQCBMX-AWEZNQCLSA-N 1 1 383.448 3.223 10 0 GGAEMO CC[N@@H+](Cc1ccc2c(c1)OCO2)[C@@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000270673202 1434759957 /nfs/dbraw/zinc/75/99/57/1434759957.db2.gz ATFNQQHDXQCBMX-AWEZNQCLSA-N 1 1 383.448 3.223 10 0 GGAEMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCC(=O)Nc1ccnn1C1CCCC1 ZINC000274798781 1435093502 /nfs/dbraw/zinc/09/35/02/1435093502.db2.gz DWVRKWLXKBWVKO-NQIIRXRSSA-N 1 1 395.551 3.437 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCC(=O)Nc1ccnn1C1CCCC1 ZINC000274798782 1435093551 /nfs/dbraw/zinc/09/35/51/1435093551.db2.gz DWVRKWLXKBWVKO-RXVVDRJESA-N 1 1 395.551 3.437 10 0 GGAEMO Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)NC[C@@H]1CCc2[nH+]ccn2C1 ZINC000275268940 1435127253 /nfs/dbraw/zinc/12/72/53/1435127253.db2.gz CIVKIAYUWCPVHB-CKDFRHGISA-N 1 1 375.476 3.078 10 0 GGAEMO CCC[C@@]1(COC)CCC[N@@H+]1Cc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1 ZINC000278050568 1435353838 /nfs/dbraw/zinc/35/38/38/1435353838.db2.gz DHHNOAJAVFAQAT-NRFANRHFSA-N 1 1 381.480 3.302 10 0 GGAEMO CCC[C@@]1(COC)CCC[N@H+]1Cc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1 ZINC000278050568 1435353841 /nfs/dbraw/zinc/35/38/41/1435353841.db2.gz DHHNOAJAVFAQAT-NRFANRHFSA-N 1 1 381.480 3.302 10 0 GGAEMO C[C@H](C(=O)Nc1ccccc1Cc1ccccc1)[N@@H+]1CC[C@@H]2NC(=O)OC[C@H]2C1 ZINC000281234980 1435800114 /nfs/dbraw/zinc/80/01/14/1435800114.db2.gz FQVLYPJUHVIYMZ-BSIFCXSSSA-N 1 1 393.487 3.035 10 0 GGAEMO C[C@H](C(=O)Nc1ccccc1Cc1ccccc1)[N@H+]1CC[C@@H]2NC(=O)OC[C@H]2C1 ZINC000281234980 1435800115 /nfs/dbraw/zinc/80/01/15/1435800115.db2.gz FQVLYPJUHVIYMZ-BSIFCXSSSA-N 1 1 393.487 3.035 10 0 GGAEMO Cc1cc(=O)n(C)cc1NC(=O)N[C@H]1CC[N@@H+](Cc2ccccc2)CC1(C)C ZINC000282595627 1435852955 /nfs/dbraw/zinc/85/29/55/1435852955.db2.gz FLOITVLUQROTGA-IBGZPJMESA-N 1 1 382.508 3.116 10 0 GGAEMO C[C@]1(O)CCOC[C@H]1[C@H]1CCC[N@H+]1CCOc1ccc(OC(F)(F)F)cc1 ZINC000284705429 1436041592 /nfs/dbraw/zinc/04/15/92/1436041592.db2.gz GPVPNOUFPDHBJK-KSZLIROESA-N 1 1 389.414 3.216 10 0 GGAEMO C[C@]1(O)CCOC[C@@H]1[C@H]1CCC[N@H+]1CCOc1ccc(OC(F)(F)F)cc1 ZINC000284705434 1436041622 /nfs/dbraw/zinc/04/16/22/1436041622.db2.gz GPVPNOUFPDHBJK-KURKYZTESA-N 1 1 389.414 3.216 10 0 GGAEMO OCC1([NH2+]Cc2nnc(-c3cc4c(s3)CCCC4)o2)Cc2ccccc2C1 ZINC000364102813 1126079802 /nfs/dbraw/zinc/07/98/02/1126079802.db2.gz SKWFMTZHXABVJC-UHFFFAOYSA-N 1 1 381.501 3.296 10 0 GGAEMO COc1ccc(OCc2nc(C[NH2+][C@H]3Cc4ccccc4[C@H]3O)cs2)cc1 ZINC000172069058 1126076844 /nfs/dbraw/zinc/07/68/44/1126076844.db2.gz BXQYVFGYXPOOAE-PZJWPPBQSA-N 1 1 382.485 3.479 10 0 GGAEMO C[C@H]1CCc2c(sc3nc(C[NH2+]C4(CO)Cc5ccccc5C4)nc(N)c23)C1 ZINC000560841400 1126097290 /nfs/dbraw/zinc/09/72/90/1126097290.db2.gz RDHYLGNTQDCXBG-ZDUSSCGKSA-N 1 1 394.544 3.018 10 0 GGAEMO C[C@@H]1CCc2c(sc3nc(C[NH2+]C4(CO)Cc5ccccc5C4)nc(N)c23)C1 ZINC000560841399 1126097323 /nfs/dbraw/zinc/09/73/23/1126097323.db2.gz RDHYLGNTQDCXBG-CYBMUJFWSA-N 1 1 394.544 3.018 10 0 GGAEMO COc1ccc(-c2cnc(C[NH2+][C@](C)(CO)Cc3ccccc3OC)o2)cc1 ZINC000931603214 1126136415 /nfs/dbraw/zinc/13/64/15/1126136415.db2.gz OCRQNCVTXMYHFD-QFIPXVFZSA-N 1 1 382.460 3.442 10 0 GGAEMO COc1ccc(-c2cnc(C[NH2+][C@@](C)(CO)Cc3ccccc3OC)o2)cc1 ZINC000931603213 1126136475 /nfs/dbraw/zinc/13/64/75/1126136475.db2.gz OCRQNCVTXMYHFD-JOCHJYFZSA-N 1 1 382.460 3.442 10 0 GGAEMO COc1cc(-c2noc(C[NH2+][C@@](C)(CO)Cc3ccccc3F)n2)ccc1C ZINC001308117119 1126163312 /nfs/dbraw/zinc/16/33/12/1126163312.db2.gz HETHIQBBJOWVMW-OAQYLSRUSA-N 1 1 385.439 3.276 10 0 GGAEMO COc1ccccc1C[C@@](C)(CO)[NH2+]Cc1nc2c3ccccc3oc2c(=O)[nH]1 ZINC001460698158 1126191943 /nfs/dbraw/zinc/19/19/43/1126191943.db2.gz PZRQIUOXEIVUBG-QFIPXVFZSA-N 1 1 393.443 3.174 10 0 GGAEMO COc1cccc(-c2nnc(C[NH2+][C@](C)(CO)Cc3ccc(Cl)cc3)o2)c1 ZINC001660393648 1126264753 /nfs/dbraw/zinc/26/47/53/1126264753.db2.gz VTZDSLPDBRWSIS-FQEVSTJZSA-N 1 1 387.867 3.482 10 0 GGAEMO O=C([C@@H]1CCCC[C@@H]1C(=O)N1CCc2ccccc21)N1CCC[N@H+]2CCC[C@H]2C1 ZINC000241401117 231039109 /nfs/dbraw/zinc/03/91/09/231039109.db2.gz NBHQIJSEWLMMLP-HBMCJLEFSA-N 1 1 395.547 3.079 10 0 GGAEMO CC(=O)N[C@H](CC(=O)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)c1ccccc1 ZINC000359996517 212130816 /nfs/dbraw/zinc/13/08/16/212130816.db2.gz RISQIIQEGABPIX-GHTZIAJQSA-N 1 1 399.560 3.344 10 0 GGAEMO CCN1CCC[C@@H](C[N@@H+](C)Cc2ccc(OC)c(OC)c2)[C@@H]1c1cnn(C)c1 ZINC000328652987 212088809 /nfs/dbraw/zinc/08/88/09/212088809.db2.gz WRVIBBMABRSXTC-PGRDOPGGSA-N 1 1 386.540 3.342 10 0 GGAEMO CC[N@@H+]1CCC[C@@H](CN(C)Cc2ccc(OC)c(OC)c2)[C@@H]1c1cnn(C)c1 ZINC000328652987 212088813 /nfs/dbraw/zinc/08/88/13/212088813.db2.gz WRVIBBMABRSXTC-PGRDOPGGSA-N 1 1 386.540 3.342 10 0 GGAEMO CC[N@H+]1CCC[C@@H](CN(C)Cc2ccc(OC)c(OC)c2)[C@@H]1c1cnn(C)c1 ZINC000328652987 212088816 /nfs/dbraw/zinc/08/88/16/212088816.db2.gz WRVIBBMABRSXTC-PGRDOPGGSA-N 1 1 386.540 3.342 10 0 GGAEMO O=C(CC[NH+]1CCOCC1)N1N=C(c2cccs2)C[C@@H]1c1ccsc1 ZINC000328599926 212083254 /nfs/dbraw/zinc/08/32/54/212083254.db2.gz ULQYSROERRGJHZ-MRXNPFEDSA-N 1 1 375.519 3.210 10 0 GGAEMO O=C(C[N@@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2)NCc1ccccc1F ZINC000007684846 221005285 /nfs/dbraw/zinc/00/52/85/221005285.db2.gz OXACGNUOOMQUGN-IBGZPJMESA-N 1 1 384.451 3.440 10 0 GGAEMO O=C(C[N@H+]1CCC[C@H]1c1ccc2c(c1)OCCCO2)NCc1ccccc1F ZINC000007684846 221005289 /nfs/dbraw/zinc/00/52/89/221005289.db2.gz OXACGNUOOMQUGN-IBGZPJMESA-N 1 1 384.451 3.440 10 0 GGAEMO CCOc1ccc(NC(=O)NC(=O)C[N@@H+](C)C2CCCCC2)cc1OCC ZINC000007786478 221012215 /nfs/dbraw/zinc/01/22/15/221012215.db2.gz CTIJUJHAUZWUKZ-UHFFFAOYSA-N 1 1 377.485 3.397 10 0 GGAEMO Cc1cc(Br)ccc1NC(=O)CNC(=O)C[N@H+](C)C1CCCCC1 ZINC000007786469 221012458 /nfs/dbraw/zinc/01/24/58/221012458.db2.gz KNSLMUQOLLIJFP-UHFFFAOYSA-N 1 1 396.329 3.077 10 0 GGAEMO CCOc1cc2c(cc1C[NH2+][C@@H](C)C(=O)Nc1ccc3c(c1)OCO3)O[C@@H](C)C2 ZINC000008734735 221053665 /nfs/dbraw/zinc/05/36/65/221053665.db2.gz ALFOPFWCYDSVCO-KBPBESRZSA-N 1 1 398.459 3.254 10 0 GGAEMO CCn1nnc2cc(C(=O)N3c4ccc(C)cc4[C@@H]4C[N@H+](C)CC[C@@H]43)ccc21 ZINC000008745145 221054456 /nfs/dbraw/zinc/05/44/56/221054456.db2.gz IPAIELBNOFVNEU-PXNSSMCTSA-N 1 1 375.476 3.208 10 0 GGAEMO C[N@H+](CC(=O)Nc1ccc2c(c1)OCO2)Cc1ccccc1N1CCCCC1 ZINC000009339386 221077829 /nfs/dbraw/zinc/07/78/29/221077829.db2.gz RRSLREBHOVXTBZ-UHFFFAOYSA-N 1 1 381.476 3.476 10 0 GGAEMO C[N@@H+](CC(=O)Nc1ccc2c(c1)OCO2)Cc1ccccc1N1CCCCC1 ZINC000009339386 221077831 /nfs/dbraw/zinc/07/78/31/221077831.db2.gz RRSLREBHOVXTBZ-UHFFFAOYSA-N 1 1 381.476 3.476 10 0 GGAEMO Cc1nn(-c2ccc(C)cc2C)nc1C(=O)NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000009516096 221084596 /nfs/dbraw/zinc/08/45/96/221084596.db2.gz XFTFJURVMHDNBI-LJQANCHMSA-N 1 1 393.491 3.352 10 0 GGAEMO O=C(Cn1c(=O)oc2ccccc21)NCCC[N@@H+](Cc1ccco1)C1CCCC1 ZINC000009688491 221090029 /nfs/dbraw/zinc/09/00/29/221090029.db2.gz XTKUBJNWJWOJJI-UHFFFAOYSA-N 1 1 397.475 3.139 10 0 GGAEMO CN(Cc1ccno1)Cc1ccc(OC[C@H](O)C[N@@H+](C)Cc2ccccc2)cc1 ZINC000012313943 221179082 /nfs/dbraw/zinc/17/90/82/221179082.db2.gz SBNQLYAQDHGTJQ-OAQYLSRUSA-N 1 1 395.503 3.178 10 0 GGAEMO CCc1ccc(S(=O)(=O)N2CCC[C@@H]([N@@H+](CC)Cc3ccncc3)C2)cc1 ZINC000012306546 221179284 /nfs/dbraw/zinc/17/92/84/221179284.db2.gz NSDGATVCNOGXPW-HXUWFJFHSA-N 1 1 387.549 3.319 10 0 GGAEMO O=C(c1ccc[nH]c1=O)N1CCC([C@@H]2CC[N@@H+](CCc3ccccc3)C2)CC1 ZINC000012194756 221165655 /nfs/dbraw/zinc/16/56/55/221165655.db2.gz GCFLHHQCZOYTSF-HXUWFJFHSA-N 1 1 379.504 3.204 10 0 GGAEMO COc1cccc(CN2CCC[C@@]3(CC[N@@H+](Cc4ccncc4)C3)C2=O)c1OC ZINC000012435538 221192887 /nfs/dbraw/zinc/19/28/87/221192887.db2.gz JHIVBUADAVVAPZ-QHCPKHFHSA-N 1 1 395.503 3.114 10 0 GGAEMO C[C@@H](C(=O)Nc1ccc(C(N)=O)cc1)[N@H+](C)Cc1ccccc1N1CCCCC1 ZINC000012554961 221205408 /nfs/dbraw/zinc/20/54/08/221205408.db2.gz NMYHIOLWQQKYQS-KRWDZBQOSA-N 1 1 394.519 3.235 10 0 GGAEMO C[C@@H](C(=O)Nc1ccc(C(N)=O)cc1)[N@@H+](C)Cc1ccccc1N1CCCCC1 ZINC000012554961 221205410 /nfs/dbraw/zinc/20/54/10/221205410.db2.gz NMYHIOLWQQKYQS-KRWDZBQOSA-N 1 1 394.519 3.235 10 0 GGAEMO COCCN1CCC[C@]2(CC[N@H+](Cc3c(C)cc(C)cc3-n3cccn3)C2)C1 ZINC000012570232 221208175 /nfs/dbraw/zinc/20/81/75/221208175.db2.gz AESSXTZRMJWKSO-QHCPKHFHSA-N 1 1 382.552 3.423 10 0 GGAEMO COCCN1CCC[C@]2(CC[N@@H+](Cc3c(C)cc(C)cc3-n3cccn3)C2)C1 ZINC000012570232 221208177 /nfs/dbraw/zinc/20/81/77/221208177.db2.gz AESSXTZRMJWKSO-QHCPKHFHSA-N 1 1 382.552 3.423 10 0 GGAEMO Cc1ccc(-c2nn(-c3cccc(F)c3)cc2C[N@@H+](C)C[C@@H]2COCCO2)o1 ZINC000012372812 221186662 /nfs/dbraw/zinc/18/66/62/221186662.db2.gz NVFYXKMAVPFAMQ-LJQANCHMSA-N 1 1 385.439 3.427 10 0 GGAEMO Cc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(C(=O)Nc3ccccc3O)CC2)cc1 ZINC000012739783 221222432 /nfs/dbraw/zinc/22/24/32/221222432.db2.gz BOULLFQVNRSBDI-MRXNPFEDSA-N 1 1 381.476 3.378 10 0 GGAEMO C[C@@H](NCc1ccccc1C[NH+]1CCCC1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000012771732 221228988 /nfs/dbraw/zinc/22/89/88/221228988.db2.gz JHXREFIVFPATDJ-QGZVFWFLSA-N 1 1 395.503 3.170 10 0 GGAEMO Cc1ccccc1NC(=O)[C@@H](C)[NH+]1CCC(C(=O)NCc2ccccc2)CC1 ZINC000012796353 221232688 /nfs/dbraw/zinc/23/26/88/221232688.db2.gz BCTAWESDENHXBU-GOSISDBHSA-N 1 1 379.504 3.350 10 0 GGAEMO COc1ccc(Br)cc1CN(C)c1[nH+]c(C)cc(C)c1C(N)=O ZINC000012905820 221243652 /nfs/dbraw/zinc/24/36/52/221243652.db2.gz FAQVTFQBAQJDSP-UHFFFAOYSA-N 1 1 378.270 3.205 10 0 GGAEMO Cc1cccc(NC(=O)[C@@H](C)[NH+]2CCC(C(=O)NCc3ccccc3)CC2)c1 ZINC000012806849 221234454 /nfs/dbraw/zinc/23/44/54/221234454.db2.gz GZVBZEMURMJKRD-GOSISDBHSA-N 1 1 379.504 3.350 10 0 GGAEMO CCc1ccccc1NC(=O)C[NH+]1CCC(C(=O)NCc2ccccc2)CC1 ZINC000012812997 221235639 /nfs/dbraw/zinc/23/56/39/221235639.db2.gz ZMIUBFUYAIYKQF-UHFFFAOYSA-N 1 1 379.504 3.216 10 0 GGAEMO COc1cc(NC(=O)[C@H](C)[N@H+](C)CCOc2ccccc2F)cc(OC)c1 ZINC000012857652 221238612 /nfs/dbraw/zinc/23/86/12/221238612.db2.gz RRQZBIVNMZUNII-AWEZNQCLSA-N 1 1 376.428 3.181 10 0 GGAEMO COc1cc(NC(=O)[C@H](C)[N@@H+](C)CCOc2ccccc2F)cc(OC)c1 ZINC000012857652 221238614 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3.356 10 0 GGAEMO COc1ccc2[nH]c(=O)c(CCC(=O)NCCC[N@H+]3CCCC[C@H]3C)cc2c1 ZINC000065245541 222114996 /nfs/dbraw/zinc/11/49/96/222114996.db2.gz KIBBEIMTIFOHFP-MRXNPFEDSA-N 1 1 385.508 3.262 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)NC[C@@H]1CCN(c2ccc(Cl)cc2)C1 ZINC000065529285 222132617 /nfs/dbraw/zinc/13/26/17/222132617.db2.gz NIXFYENLBYHNMA-SJORKVTESA-N 1 1 378.948 3.340 10 0 GGAEMO O=C(CCC(=O)N1CCC[N@H+]2CCC[C@H]2C1)c1ccc(Br)cc1 ZINC000065578402 222134742 /nfs/dbraw/zinc/13/47/42/222134742.db2.gz SWELHWSCNVFVCT-INIZCTEOSA-N 1 1 379.298 3.109 10 0 GGAEMO O[C@H](CN1CC[NH+](CCOc2ccc(Cl)cc2)CC1)c1ccccc1F ZINC000065591045 222135012 /nfs/dbraw/zinc/13/50/12/222135012.db2.gz VPZZVQWPQUGKQH-HXUWFJFHSA-N 1 1 378.875 3.209 10 0 GGAEMO Cc1cccnc1N1CC[NH+](Cc2c(-c3ccccc3)nc3ncccn23)CC1 ZINC000067883919 222165198 /nfs/dbraw/zinc/16/51/98/222165198.db2.gz UQDUVBMZGOCLGC-UHFFFAOYSA-N 1 1 384.487 3.422 10 0 GGAEMO CCn1ccnc1C[N@@H+]1CC[C@]2(C1)CCCN(C(=O)CCc1ccccc1)C2 ZINC000067946382 222169976 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GGAEMO COc1ccc(CC[N@@H+](C)[C@H]2CCCN(c3ncnc4[nH]ccc43)C2)cc1OC ZINC000072127293 222208451 /nfs/dbraw/zinc/20/84/51/222208451.db2.gz ZSAXDXQXWPGDSU-KRWDZBQOSA-N 1 1 395.507 3.118 10 0 GGAEMO c1ccc(C[NH+]2CCC(Nc3nc(-c4cccnc4)nc4c3CNC4)CC2)cc1 ZINC000072156991 222213326 /nfs/dbraw/zinc/21/33/26/222213326.db2.gz VFOYQVZRNODMJX-UHFFFAOYSA-N 1 1 386.503 3.218 10 0 GGAEMO O=C(CC1CCCCC1)N1CCC[N@@H+]([C@@H]2CCN(Cc3ccccc3)C2=O)CC1 ZINC000085824356 222324683 /nfs/dbraw/zinc/32/46/83/222324683.db2.gz DXXARJUBOSTUNP-JOCHJYFZSA-N 1 1 397.563 3.292 10 0 GGAEMO O=C(CC1CCCCC1)N1CCC[N@H+]([C@@H]2CCN(Cc3ccccc3)C2=O)CC1 ZINC000085824356 222324687 /nfs/dbraw/zinc/32/46/87/222324687.db2.gz DXXARJUBOSTUNP-JOCHJYFZSA-N 1 1 397.563 3.292 10 0 GGAEMO CCc1cccc(CC)c1NC(=O)COC(=O)c1cnn(-c2cc[nH+]cc2)c1C ZINC000089289547 222326394 /nfs/dbraw/zinc/32/63/94/222326394.db2.gz IHHLVXFAONZIGC-UHFFFAOYSA-N 1 1 392.459 3.496 10 0 GGAEMO O=C(N[C@@H]1C[NH+]2CCC1CC2)c1cc(Br)c(Br)s1 ZINC000095082526 222329155 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394.494 3.312 10 0 GGAEMO Cn1ccnc1[C@H]([NH2+]C[C@H](c1ccccc1)N1CCOCC1)c1cccc(F)c1 ZINC000096003254 222369280 /nfs/dbraw/zinc/36/92/80/222369280.db2.gz YKOAZNUSRQRRDU-FGZHOGPDSA-N 1 1 394.494 3.312 10 0 GGAEMO COc1ccc(CN2c3ccccc3O[C@H]3C[C@@H](C2=O)[N@@H+](CC2CC2)C3)cc1 ZINC000096111880 222381503 /nfs/dbraw/zinc/38/15/03/222381503.db2.gz WIXREULYZRMGJR-FPOVZHCZSA-N 1 1 378.472 3.474 10 0 biogenic GGAEMO CC(=O)N[C@@H](CC(=O)Nc1ccccc1C[NH+]1CCSCC1)c1ccccc1 ZINC000109486031 222514519 /nfs/dbraw/zinc/51/45/19/222514519.db2.gz NYMHDQOBDLDDIF-NRFANRHFSA-N 1 1 397.544 3.441 10 0 GGAEMO CCOc1ccc([C@@H]2Nc3ccccc3C(=O)N2CCC[NH+]2CCOCC2)cc1 ZINC000012608562 521245188 /nfs/dbraw/zinc/24/51/88/521245188.db2.gz MZVBHPLEWDNFFB-JOCHJYFZSA-N 1 1 395.503 3.374 10 0 GGAEMO CC[N@H+]1CCC[C@@H](CNc2ncnc3cccc(I)c32)C1 ZINC000543032172 564335418 /nfs/dbraw/zinc/33/54/18/564335418.db2.gz COKJYWPBQDHYSC-LBPRGKRZSA-N 1 1 396.276 3.378 10 0 GGAEMO Cc1cccc(C(=O)NCC[N@@H+]2CCCC[C@@H]2C)c1I ZINC000047144293 564514384 /nfs/dbraw/zinc/51/43/84/564514384.db2.gz ZBMFOEMARPCMHB-ZDUSSCGKSA-N 1 1 386.277 3.204 10 0 GGAEMO CN(C[C@@H]1CC[N@@H+](C)C1)C(=O)c1cc(Br)cc(Br)c1 ZINC000222910795 565906562 /nfs/dbraw/zinc/90/65/62/565906562.db2.gz YVEOYZSMKWQCES-SNVBAGLBSA-N 1 1 390.119 3.235 10 0 GGAEMO C[C@@H]1C[C@H](N(C)Cc2ccc(F)cc2I)CC[N@H+]1C ZINC000417770659 566174707 /nfs/dbraw/zinc/17/47/07/566174707.db2.gz CJOHUVJNBGKUTN-BXUZGUMPSA-N 1 1 376.257 3.345 10 0 GGAEMO COCC[N@H+](Cc1ccc(I)cc1Cl)[C@@H]1CCOC1 ZINC000503576955 567494654 /nfs/dbraw/zinc/49/46/54/567494654.db2.gz JIONHOXSLRDOOF-CYBMUJFWSA-N 1 1 395.668 3.182 10 0 GGAEMO COCC[N@@H+](Cc1ccc(I)cc1Cl)[C@@H]1CCOC1 ZINC000503576955 567494663 /nfs/dbraw/zinc/49/46/63/567494663.db2.gz JIONHOXSLRDOOF-CYBMUJFWSA-N 1 1 395.668 3.182 10 0 GGAEMO CC(C)C1(CNC(=O)c2sc3c(c2I)C[NH2+]C3)CC1 ZINC000595938869 567594171 /nfs/dbraw/zinc/59/41/71/567594171.db2.gz BBLDTMWCDYHMHK-UHFFFAOYSA-N 1 1 390.290 3.122 10 0 GGAEMO CCOCCC[N@H+]1CC[C@@H](NC(=O)c2csc(Br)c2)[C@H](C)C1 ZINC000115270941 564189838 /nfs/dbraw/zinc/18/98/38/564189838.db2.gz HKYMVLBGDCVTKC-TZMCWYRMSA-N 1 1 389.359 3.377 10 0 GGAEMO Cc1ccc(I)c(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)c1 ZINC000115432562 564193596 /nfs/dbraw/zinc/19/35/96/564193596.db2.gz ACYAZLMVDRNSGH-CYBMUJFWSA-N 1 1 386.277 3.013 10 0 GGAEMO C[C@@H]1C[N@H+](C2CCN(C(=O)/C=C/c3csc(Br)c3)CC2)CCO1 ZINC000116196157 564205447 /nfs/dbraw/zinc/20/54/47/564205447.db2.gz OYCKIDAKDFTYPL-YWVDXFKGSA-N 1 1 399.354 3.236 10 0 GGAEMO C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC(=O)c1ccc(Br)o1 ZINC000116246962 564206177 /nfs/dbraw/zinc/20/61/77/564206177.db2.gz XNWJQHPRVQUCQH-OCCSQVGLSA-N 1 1 378.270 3.078 10 0 GGAEMO C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC(=O)c1ccc(Br)cc1 ZINC000116248235 564206269 /nfs/dbraw/zinc/20/62/69/564206269.db2.gz NRHDLDSVOUUIAY-KDOFPFPSSA-N 1 1 388.309 3.485 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC(=O)c1nc(Cl)ccc1Cl ZINC000116248964 564206459 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3.394 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)c2sc(C)cc2OC(F)F)C[C@@H]1CC ZINC000116769829 564216149 /nfs/dbraw/zinc/21/61/49/564216149.db2.gz OZNJUQFFXBRPAD-ZDUSSCGKSA-N 1 1 376.469 3.231 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)c2sc(C)cc2OC(F)F)C[C@@H]1CC ZINC000116769829 564216153 /nfs/dbraw/zinc/21/61/53/564216153.db2.gz OZNJUQFFXBRPAD-ZDUSSCGKSA-N 1 1 376.469 3.231 10 0 GGAEMO CC[N@H+]1CC[C@@H](CNC(=O)c2cc(Br)sc2Br)C1 ZINC000116732533 564216189 /nfs/dbraw/zinc/21/61/89/564216189.db2.gz QBLRGESXCXHZTO-QMMMGPOBSA-N 1 1 396.148 3.345 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)c2cc(Br)cs2)C[C@H]1CC ZINC000116768479 564216327 /nfs/dbraw/zinc/21/63/27/564216327.db2.gz MLOKYWRJFQMBEA-CYBMUJFWSA-N 1 1 375.332 3.084 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)c2cc(Br)cs2)C[C@H]1CC ZINC000116768479 564216332 /nfs/dbraw/zinc/21/63/32/564216332.db2.gz MLOKYWRJFQMBEA-CYBMUJFWSA-N 1 1 375.332 3.084 10 0 GGAEMO C[N@@H+](Cc1cc(Br)cs1)C1CCN(CCn2cccn2)CC1 ZINC000116878832 564219073 /nfs/dbraw/zinc/21/90/73/564219073.db2.gz 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Cc1cc(C)n2c(C[N@@H+](C)[C@H](CO)c3cccc(Br)c3)cnc2n1 ZINC000093815554 564890167 /nfs/dbraw/zinc/89/01/67/564890167.db2.gz FXEPXMNJQBTJTP-QGZVFWFLSA-N 1 1 389.297 3.274 10 0 GGAEMO Cc1cc(C)n2c(C[N@H+](C)[C@H](CO)c3cccc(Br)c3)cnc2n1 ZINC000093815554 564890171 /nfs/dbraw/zinc/89/01/71/564890171.db2.gz FXEPXMNJQBTJTP-QGZVFWFLSA-N 1 1 389.297 3.274 10 0 GGAEMO CC(C)[N@@H+]1C[C@H](NC(=O)C(=O)Nc2cc(Cl)c(Cl)cc2Cl)[C@@H](C)C1 ZINC000150785334 564891238 /nfs/dbraw/zinc/89/12/38/564891238.db2.gz QNBMFZQRNKVRIG-XPTSAGLGSA-N 1 1 392.714 3.430 10 0 GGAEMO NC(=O)c1c(F)cc(Br)cc1N1CC[NH+](Cc2cccs2)CC1 ZINC000094132255 564897178 /nfs/dbraw/zinc/89/71/78/564897178.db2.gz UOAYXVMMNADSFI-UHFFFAOYSA-N 1 1 398.301 3.071 10 0 GGAEMO OC[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1ccccc1Br ZINC000095400277 564898925 /nfs/dbraw/zinc/89/89/25/564898925.db2.gz BWBCWGDOLIIYDN-AZUAARDMSA-N 1 1 389.337 3.422 10 0 GGAEMO OC[C@@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccccc1Br ZINC000095400277 564898929 /nfs/dbraw/zinc/89/89/29/564898929.db2.gz BWBCWGDOLIIYDN-AZUAARDMSA-N 1 1 389.337 3.422 10 0 GGAEMO Cc1sc2cc(C(=O)NCc3cccs3)[nH]c2c1C[NH+]1CCOCC1 ZINC000096363772 564901151 /nfs/dbraw/zinc/90/11/51/564901151.db2.gz DJCAQMYKKPESBC-UHFFFAOYSA-N 1 1 375.519 3.362 10 0 GGAEMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1S(=O)(=O)c1c(Cl)cccc1C(F)(F)F ZINC000151191329 564909186 /nfs/dbraw/zinc/90/91/86/564909186.db2.gz FFYFYKIWYKILCF-GHMZBOCLSA-N 1 1 382.835 3.216 10 0 GGAEMO O[C@@H](CSc1ccc(Br)cn1)C[N@H+]1CCc2ccccc2C1 ZINC000098144706 564914231 /nfs/dbraw/zinc/91/42/31/564914231.db2.gz YTRJURYQXDATFG-MRXNPFEDSA-N 1 1 379.323 3.355 10 0 GGAEMO CCCC(=O)N[C@H]1CCC[N@@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000101563197 564917088 /nfs/dbraw/zinc/91/70/88/564917088.db2.gz CGQHNXFEXQSOLV-GJZGRUSLSA-N 1 1 389.323 3.114 10 0 GGAEMO CCCC(=O)N[C@@H]1CCC[N@@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000101563196 564917456 /nfs/dbraw/zinc/91/74/56/564917456.db2.gz CGQHNXFEXQSOLV-CABCVRRESA-N 1 1 389.323 3.114 10 0 GGAEMO C[C@H]([NH2+]CC(=O)NC(=O)Nc1ccccc1)c1ccccc1Br ZINC000102684037 564932526 /nfs/dbraw/zinc/93/25/26/564932526.db2.gz HSQZKROPKFXJKC-LBPRGKRZSA-N 1 1 376.254 3.448 10 0 GGAEMO O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)c1coc(Br)c1 ZINC000103132922 564942889 /nfs/dbraw/zinc/94/28/89/564942889.db2.gz ORABSRFWWQOBMB-HNNXBMFYSA-N 1 1 377.282 3.337 10 0 GGAEMO NC(=O)[C@H]([NH2+]CCOCc1ccc(Cl)cc1)c1ccc(Br)cc1 ZINC000152034950 564944863 /nfs/dbraw/zinc/94/48/63/564944863.db2.gz UGKLOTDYSGMRSQ-MRXNPFEDSA-N 1 1 397.700 3.435 10 0 GGAEMO C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1CCOc1ccc(Cl)cc1Br ZINC000103286244 564945334 /nfs/dbraw/zinc/94/53/34/564945334.db2.gz ARJNBEPWVQJIHE-GHMZBOCLSA-N 1 1 375.694 3.067 10 0 GGAEMO C[C@@H]1CC[C@H](C(N)=O)C[N@@H+]1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000103284266 564945824 /nfs/dbraw/zinc/94/58/24/564945824.db2.gz UKOMDFNXBJLMDK-OLZOCXBDSA-N 1 1 379.913 3.461 10 0 GGAEMO C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1csc(COc2ccc(Cl)cc2)n1 ZINC000103284266 564945827 /nfs/dbraw/zinc/94/58/27/564945827.db2.gz UKOMDFNXBJLMDK-OLZOCXBDSA-N 1 1 379.913 3.461 10 0 GGAEMO O[C@H](COc1ccc(Cl)cc1Cl)C[N@H+]1CC[C@@H](Oc2cccnc2)C1 ZINC000152288112 564953363 /nfs/dbraw/zinc/95/33/63/564953363.db2.gz PZXBMLBEAPFEHP-GOEBONIOSA-N 1 1 383.275 3.281 10 0 GGAEMO Cc1nc(-c2ccc(CCNC(=O)N3CC[NH+](C4CC4)CC3)s2)cs1 ZINC000105095806 564963541 /nfs/dbraw/zinc/96/35/41/564963541.db2.gz LRRWFUCDUVAFGL-UHFFFAOYSA-N 1 1 376.551 3.212 10 0 GGAEMO C[C@H]([NH2+][C@H](C(N)=O)c1ccc(Br)cc1)c1ccc2c(c1)OCO2 ZINC000105400748 564966171 /nfs/dbraw/zinc/96/61/71/564966171.db2.gz CINBSAGQUUXBOQ-QFYYESIMSA-N 1 1 377.238 3.055 10 0 GGAEMO COc1ccc([C@@H](C)[NH2+][C@@H](C(N)=O)c2ccc(Br)cc2)cc1OC ZINC000105401362 564967214 /nfs/dbraw/zinc/96/72/14/564967214.db2.gz BWCCDJZMBVOKRM-PIGZYNQJSA-N 1 1 393.281 3.344 10 0 GGAEMO CC[N@H+]1CCC[C@@H](NC(=O)C(=O)Nc2cc(Cl)ccc2SC(C)C)C1 ZINC000105534232 564968981 /nfs/dbraw/zinc/96/89/81/564968981.db2.gz HBFJSQROMOKXTO-CQSZACIVSA-N 1 1 383.945 3.380 10 0 GGAEMO CC[C@@H](CO)[NH+]1CCN(C(=O)Nc2ccc(Cl)cc2Br)CC1 ZINC000152884343 564975433 /nfs/dbraw/zinc/97/54/33/564975433.db2.gz MMAGMURCYAFDDA-LBPRGKRZSA-N 1 1 390.709 3.023 10 0 GGAEMO CCOCC[N@H+]1CCN(CC(=O)Nc2ccc(Cl)cc2Cl)C[C@@H]1CC ZINC000106119091 564977799 /nfs/dbraw/zinc/97/77/99/564977799.db2.gz LYVKDVHFKDHJAJ-HNNXBMFYSA-N 1 1 388.339 3.365 10 0 GGAEMO COCC[N@@H+]1CCN(CC(=O)Nc2cc(Cl)c(Cl)cc2Cl)C[C@@H]1C ZINC000106109745 564978245 /nfs/dbraw/zinc/97/82/45/564978245.db2.gz CAICCKJFUIGJDI-NSHDSACASA-N 1 1 394.730 3.238 10 0 GGAEMO COCC[N@H+]1CCN(CC(=O)Nc2cc(Cl)c(Cl)cc2Cl)C[C@@H]1C ZINC000106109745 564978247 /nfs/dbraw/zinc/97/82/47/564978247.db2.gz CAICCKJFUIGJDI-NSHDSACASA-N 1 1 394.730 3.238 10 0 GGAEMO CC[C@H]1CN(CCC(=O)Nc2cc(Cl)ccc2Cl)CC[N@H+]1C[C@@H](C)O ZINC000106102760 564978367 /nfs/dbraw/zinc/97/83/67/564978367.db2.gz SVWNYZDULMDBGR-HIFRSBDPSA-N 1 1 388.339 3.099 10 0 GGAEMO CC[C@H]1C[N@H+](CCC(=O)Nc2cc(Cl)ccc2Cl)CCN1C[C@@H](C)O ZINC000106102760 564978370 /nfs/dbraw/zinc/97/83/70/564978370.db2.gz SVWNYZDULMDBGR-HIFRSBDPSA-N 1 1 388.339 3.099 10 0 GGAEMO CC[C@H]1C[N@@H+](CCC(=O)Nc2cc(Cl)ccc2Cl)CCN1C[C@@H](C)O ZINC000106102760 564978371 /nfs/dbraw/zinc/97/83/71/564978371.db2.gz SVWNYZDULMDBGR-HIFRSBDPSA-N 1 1 388.339 3.099 10 0 GGAEMO O=C(C[N@@H+](C[C@H]1CCCO1)C1CCCC1)Nc1ccc(Br)cn1 ZINC000152969159 564978860 /nfs/dbraw/zinc/97/88/60/564978860.db2.gz VZIRRBNISQPINR-OAHLLOKOSA-N 1 1 382.302 3.206 10 0 GGAEMO C[C@@H](C(=O)Nc1ccc(Cl)c(Cl)c1)[N@H+]1CCC[C@H](Cn2cncn2)C1 ZINC000106173461 564979132 /nfs/dbraw/zinc/97/91/32/564979132.db2.gz RFHRQSYBPCNODX-STQMWFEESA-N 1 1 382.295 3.324 10 0 GGAEMO C[C@H](C(=O)Nc1cc(Cl)ccc1Cl)[N@@H+]1CCC[C@H](Cn2cncn2)C1 ZINC000106176454 564979195 /nfs/dbraw/zinc/97/91/95/564979195.db2.gz QGMDZSMWPBDFGQ-OLZOCXBDSA-N 1 1 382.295 3.324 10 0 GGAEMO C[C@H](C(=O)Nc1cc(Cl)ccc1Cl)[N@H+]1CCC[C@H](Cn2cncn2)C1 ZINC000106176454 564979198 /nfs/dbraw/zinc/97/91/98/564979198.db2.gz QGMDZSMWPBDFGQ-OLZOCXBDSA-N 1 1 382.295 3.324 10 0 GGAEMO Cn1cc(C[N@H+]2CCCN(Cc3ccc(Br)cc3F)CC2)cn1 ZINC000106157787 564979206 /nfs/dbraw/zinc/97/92/06/564979206.db2.gz MSRLGRFGAGCJSU-UHFFFAOYSA-N 1 1 381.293 3.030 10 0 GGAEMO Cn1cc(C[N@H+]2CCCN(Cc3cc(Br)ccc3F)CC2)cn1 ZINC000106154600 564979269 /nfs/dbraw/zinc/97/92/69/564979269.db2.gz MOUDBZVUPIVBRZ-UHFFFAOYSA-N 1 1 381.293 3.030 10 0 GGAEMO C[C@H](C(=O)Nc1cccc(Cl)c1Cl)[N@@H+]1CCC[C@H](Cn2cncn2)C1 ZINC000106174167 564979732 /nfs/dbraw/zinc/97/97/32/564979732.db2.gz FWBOXOWNDARFNY-OLZOCXBDSA-N 1 1 382.295 3.324 10 0 GGAEMO C[C@H](C(=O)Nc1cccc(Cl)c1Cl)[N@H+]1CCC[C@H](Cn2cncn2)C1 ZINC000106174167 564979736 /nfs/dbraw/zinc/97/97/36/564979736.db2.gz FWBOXOWNDARFNY-OLZOCXBDSA-N 1 1 382.295 3.324 10 0 GGAEMO Cc1nn(C)c(C)c1C[NH+]1CCN(Cc2ccc(F)c(Br)c2)CC1 ZINC000106141985 564979746 /nfs/dbraw/zinc/97/97/46/564979746.db2.gz RXPWHCCOBRVOGS-UHFFFAOYSA-N 1 1 395.320 3.256 10 0 GGAEMO CC[C@H](O)C[NH+]1CCN(C(=O)c2ccc(C3SCCCS3)cc2)CC1 ZINC000106395063 564982815 /nfs/dbraw/zinc/98/28/15/564982815.db2.gz QNQWMBIMJYGYGM-KRWDZBQOSA-N 1 1 380.579 3.084 10 0 GGAEMO CC[C@@H]1C[N@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)CCN1CC(F)F ZINC000153451523 564995701 /nfs/dbraw/zinc/99/57/01/564995701.db2.gz MXQQOTWORCWPSJ-KGLIPLIRSA-N 1 1 397.293 3.394 10 0 GGAEMO CC[C@@H]1C[N@@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)CCN1CC(F)F ZINC000153451523 564995705 /nfs/dbraw/zinc/99/57/05/564995705.db2.gz MXQQOTWORCWPSJ-KGLIPLIRSA-N 1 1 397.293 3.394 10 0 GGAEMO CC[C@H]1C[N@H+](C[C@H](O)COc2c(Cl)cccc2Cl)CCN1CC(F)F ZINC000153505496 564998032 /nfs/dbraw/zinc/99/80/32/564998032.db2.gz ZERXVCSNZHPADL-STQMWFEESA-N 1 1 397.293 3.394 10 0 GGAEMO CC[C@H]1C[N@@H+](C[C@H](O)COc2c(Cl)cccc2Cl)CCN1CC(F)F ZINC000153505496 564998035 /nfs/dbraw/zinc/99/80/35/564998035.db2.gz ZERXVCSNZHPADL-STQMWFEESA-N 1 1 397.293 3.394 10 0 GGAEMO CC[C@@H]1C[N@H+](C[C@H](O)COc2c(Cl)cccc2Cl)CCN1CC(F)F ZINC000153505389 564998063 /nfs/dbraw/zinc/99/80/63/564998063.db2.gz ZERXVCSNZHPADL-OLZOCXBDSA-N 1 1 397.293 3.394 10 0 GGAEMO CC[C@@H]1C[N@@H+](C[C@H](O)COc2c(Cl)cccc2Cl)CCN1CC(F)F ZINC000153505389 564998066 /nfs/dbraw/zinc/99/80/66/564998066.db2.gz ZERXVCSNZHPADL-OLZOCXBDSA-N 1 1 397.293 3.394 10 0 GGAEMO COC(=O)c1cc(Br)ccc1NC(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000153551300 565000372 /nfs/dbraw/zinc/00/03/72/565000372.db2.gz JYGYOEMVNSNISP-YPMHNXCESA-N 1 1 398.301 3.182 10 0 GGAEMO Ic1cccc(OCCC[N@H+]2CC[C@@]3(CCOC3)C2)c1 ZINC000153630245 565003823 /nfs/dbraw/zinc/00/38/23/565003823.db2.gz VDQXSKVWGLLGCG-MRXNPFEDSA-N 1 1 387.261 3.173 10 0 GGAEMO CC[N@H+]1CC[C@H](CNC(=O)Cn2c(C)c(Br)c3ccccc32)C1 ZINC000107895163 565003837 /nfs/dbraw/zinc/00/38/37/565003837.db2.gz YYVYBWHBKWVCOQ-CQSZACIVSA-N 1 1 378.314 3.170 10 0 GGAEMO CC[N@H+]1CC[C@@H](CNC(=O)c2cc(C)nc3ccc(Br)cc32)C1 ZINC000107886762 565003977 /nfs/dbraw/zinc/00/39/77/565003977.db2.gz ZNODNMJNMMZKPL-ZDUSSCGKSA-N 1 1 376.298 3.377 10 0 GGAEMO CC[N@H+]1CC[C@@H](CNC(=O)COc2ccc3cc(Br)ccc3c2)C1 ZINC000107892268 565003989 /nfs/dbraw/zinc/00/39/89/565003989.db2.gz NDLGGWGKWHATDO-AWEZNQCLSA-N 1 1 391.309 3.439 10 0 GGAEMO CC[N@H+]1CC[C@H](CNC(=O)CCCCOc2ccc(Br)cc2)C1 ZINC000108781631 565017301 /nfs/dbraw/zinc/01/73/01/565017301.db2.gz QKOYVVJEPMIOKP-OAHLLOKOSA-N 1 1 383.330 3.456 10 0 GGAEMO COCC[N@H+]1CCN(Cc2coc(-c3ccc(Br)cc3)n2)C[C@@H]1C ZINC000108867425 565018138 /nfs/dbraw/zinc/01/81/38/565018138.db2.gz ACMWBFVHTKAVNV-AWEZNQCLSA-N 1 1 394.313 3.257 10 0 GGAEMO Cc1cnn(C[C@H]2CN(c3cc[nH+]c4ccc(Br)cc43)CCO2)c1 ZINC000108950438 565018961 /nfs/dbraw/zinc/01/89/61/565018961.db2.gz JUFFYHGWVZYNGC-OAHLLOKOSA-N 1 1 387.281 3.408 10 0 GGAEMO Cc1cnn(C[C@@H]2CN(c3cc[nH+]c4ccc(Br)cc43)CCO2)c1 ZINC000108950437 565019065 /nfs/dbraw/zinc/01/90/65/565019065.db2.gz JUFFYHGWVZYNGC-HNNXBMFYSA-N 1 1 387.281 3.408 10 0 GGAEMO Cn1cc(C[N@@H+]2CCCN(C(=O)Cc3c(Cl)cccc3Cl)CC2)cn1 ZINC000109658717 565029203 /nfs/dbraw/zinc/02/92/03/565029203.db2.gz FTYCDNDDZFTGDB-UHFFFAOYSA-N 1 1 381.307 3.004 10 0 GGAEMO Cn1cc(C[N@H+]2CCCN(C(=O)Cc3c(Cl)cccc3Cl)CC2)cn1 ZINC000109658717 565029205 /nfs/dbraw/zinc/02/92/05/565029205.db2.gz FTYCDNDDZFTGDB-UHFFFAOYSA-N 1 1 381.307 3.004 10 0 GGAEMO COc1ccc(Br)cc1CN1CCN(C[C@H]2CCCC[N@H+]2C)CC1 ZINC000109755695 565031094 /nfs/dbraw/zinc/03/10/94/565031094.db2.gz RHFOKYFMBQDTFK-GOSISDBHSA-N 1 1 396.373 3.060 10 0 GGAEMO O=C(C[N@@H+]1CCCC[C@H]1CN1CCOCC1)Nc1ccc(Cl)c(Cl)c1 ZINC000109821016 565031919 /nfs/dbraw/zinc/03/19/19/565031919.db2.gz BFSVCVOFIUZGLB-HNNXBMFYSA-N 1 1 386.323 3.119 10 0 GGAEMO O=C(C[N@H+]1CCCC[C@H]1CN1CCOCC1)Nc1ccc(Cl)c(Cl)c1 ZINC000109821016 565031925 /nfs/dbraw/zinc/03/19/25/565031925.db2.gz BFSVCVOFIUZGLB-HNNXBMFYSA-N 1 1 386.323 3.119 10 0 GGAEMO C[NH+]1CCN(C(=O)CC2CCN(Cc3c(Cl)cccc3Cl)CC2)CC1 ZINC000109790146 565032172 /nfs/dbraw/zinc/03/21/72/565032172.db2.gz CPAZLIPESVHBQG-UHFFFAOYSA-N 1 1 384.351 3.370 10 0 GGAEMO Cc1ccc(I)c(C(=O)N2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)c1 ZINC000154434048 565039461 /nfs/dbraw/zinc/03/94/61/565039461.db2.gz XWMFHMBLKPBKKG-CJNGLKHVSA-N 1 1 398.288 3.156 10 0 GGAEMO CC[N@H+]1CCC[C@@H](NC(=O)c2ccc(Br)cc2Br)C1 ZINC000154491626 565041653 /nfs/dbraw/zinc/04/16/53/565041653.db2.gz WHAKRSGZFHZRBU-LLVKDONJSA-N 1 1 390.119 3.426 10 0 GGAEMO NC(=O)C[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 ZINC000110529862 565041838 /nfs/dbraw/zinc/04/18/38/565041838.db2.gz OCUTZWOLWIFXKU-NSHDSACASA-N 1 1 377.794 3.027 10 0 GGAEMO Cc1nccn1C[C@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1Br ZINC000154565925 565044890 /nfs/dbraw/zinc/04/48/90/565044890.db2.gz YGBQNPZOQABFFG-OAHLLOKOSA-N 1 1 391.313 3.447 10 0 GGAEMO O=C(CCc1cccc(Br)c1)N1CCCC[C@H]1C[NH+]1CCOCC1 ZINC000110953825 565048211 /nfs/dbraw/zinc/04/82/11/565048211.db2.gz YEJCUSBKIZUMFE-SFHVURJKSA-N 1 1 395.341 3.095 10 0 GGAEMO C[C@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(Br)c(Cl)c2)CC[N@H+]1C ZINC000154697003 565049589 /nfs/dbraw/zinc/04/95/89/565049589.db2.gz MUABOXVIZRWDLW-QWRGUYRKSA-N 1 1 395.750 3.206 10 0 GGAEMO C[C@H]1C[C@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2Cl)CC[N@H+]1C ZINC000154698078 565049861 /nfs/dbraw/zinc/04/98/61/565049861.db2.gz ODDTWDNRIZBJDX-CMPLNLGQSA-N 1 1 384.851 3.462 10 0 GGAEMO CN1CCN(C(=O)CC2CC[NH+](Cc3ccc(Cl)c(Cl)c3)CC2)CC1 ZINC000111241487 565052111 /nfs/dbraw/zinc/05/21/11/565052111.db2.gz JILITFNSHVRTTB-UHFFFAOYSA-N 1 1 384.351 3.370 10 0 GGAEMO C[NH+]1CCN(C(=O)CC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)CC1 ZINC000111241487 565052112 /nfs/dbraw/zinc/05/21/12/565052112.db2.gz JILITFNSHVRTTB-UHFFFAOYSA-N 1 1 384.351 3.370 10 0 GGAEMO CCc1nc(C[NH+]2CCC(CNC(=O)N3CCS[C@@H](C)C3)CC2)cs1 ZINC000111520435 565055315 /nfs/dbraw/zinc/05/53/15/565055315.db2.gz QPFCGMWONRQYKT-AWEZNQCLSA-N 1 1 382.599 3.064 10 0 GGAEMO Cc1ccc(C(=O)N2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)cc1I ZINC000154948924 565057631 /nfs/dbraw/zinc/05/76/31/565057631.db2.gz AOUFIMBWLXPOSR-GOEBONIOSA-N 1 1 398.288 3.156 10 0 GGAEMO COc1cccc(Br)c1OC[C@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000154954206 565058021 /nfs/dbraw/zinc/05/80/21/565058021.db2.gz XUJNBVDLEBYASV-MRXNPFEDSA-N 1 1 392.293 3.256 10 0 GGAEMO C[C@H](NC(=O)C[NH+]1CCC(OCCCO)CC1)c1ccc(Cl)cc1Cl ZINC000154971306 565058554 /nfs/dbraw/zinc/05/85/54/565058554.db2.gz BAAYBLSWHJHDNU-ZDUSSCGKSA-N 1 1 389.323 3.034 10 0 GGAEMO C[C@H](c1ccc(Br)cc1)[N@H+]1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000112337941 565062643 /nfs/dbraw/zinc/06/26/43/565062643.db2.gz JYSAAVGLXWGPJP-ZBFHGGJFSA-N 1 1 381.314 3.081 10 0 GGAEMO Cc1nc(CN2CCC[N@@H+]([C@@H](C)c3ccc(Br)cc3)CC2)no1 ZINC000112345496 565062683 /nfs/dbraw/zinc/06/26/83/565062683.db2.gz XPSDUVLJKNMUQH-ZDUSSCGKSA-N 1 1 379.302 3.409 10 0 GGAEMO Cc1nc(CN2CCC[N@H+]([C@@H](C)c3ccc(Br)cc3)CC2)no1 ZINC000112345496 565062685 /nfs/dbraw/zinc/06/26/85/565062685.db2.gz XPSDUVLJKNMUQH-ZDUSSCGKSA-N 1 1 379.302 3.409 10 0 GGAEMO C[C@H](c1ccc(Br)cc1)N1CCC[N@@H+](Cc2cnn(C)c2)CC1 ZINC000112345513 565062739 /nfs/dbraw/zinc/06/27/39/565062739.db2.gz ITWMVGUHMDQHNB-OAHLLOKOSA-N 1 1 377.330 3.452 10 0 GGAEMO CCOc1c(Br)cc(C(=O)N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)cc1OC ZINC000155386334 565066948 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GGAEMO C[N@H+]1CCC[C@H]2CN(C(=O)c3cc4c(cccc4Br)[nH]3)CC[C@@H]21 ZINC000155774300 565071488 /nfs/dbraw/zinc/07/14/88/565071488.db2.gz PDIACVANZLCOEB-SJCJKPOMSA-N 1 1 376.298 3.487 10 0 GGAEMO C[C@@H]1C[N@H+](C(C)(C)CNC(=O)Cc2ccc(Br)s2)C[C@H](C)O1 ZINC000114228662 565073069 /nfs/dbraw/zinc/07/30/69/565073069.db2.gz GBUZSAJCINGWCZ-TXEJJXNPSA-N 1 1 389.359 3.057 10 0 GGAEMO C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)Cc2ccc(Br)s2)C[C@H](C)O1 ZINC000114228662 565073071 /nfs/dbraw/zinc/07/30/71/565073071.db2.gz GBUZSAJCINGWCZ-TXEJJXNPSA-N 1 1 389.359 3.057 10 0 GGAEMO C[NH+](C)[C@@H](CNC(=O)C(=O)c1ccc(Br)cc1)c1cccs1 ZINC000114314378 565073712 /nfs/dbraw/zinc/07/37/12/565073712.db2.gz AESFCYOCHSEPNX-ZDUSSCGKSA-N 1 1 381.295 3.112 10 0 GGAEMO CN(Cc1ccccc1Br)C(=O)C[N@@H+]1CCCC[C@H]1c1cn[nH]c1 ZINC000114483305 565074630 /nfs/dbraw/zinc/07/46/30/565074630.db2.gz LEGVSDOTUNJAMC-KRWDZBQOSA-N 1 1 391.313 3.358 10 0 GGAEMO CN(Cc1ccccc1Br)C(=O)C[N@H+]1CCCC[C@H]1c1cn[nH]c1 ZINC000114483305 565074631 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GGAEMO CC(C)[N@H+](CC(=O)Nc1c(F)cc(F)cc1Br)[C@H]1CCOC1 ZINC000292014160 565092217 /nfs/dbraw/zinc/09/22/17/565092217.db2.gz XYHKRYQCMBWYOI-NSHDSACASA-N 1 1 377.229 3.165 10 0 GGAEMO CC(C)[N@@H+](CC(=O)Nc1c(F)cc(F)cc1Br)[C@H]1CCOC1 ZINC000292014160 565092220 /nfs/dbraw/zinc/09/22/20/565092220.db2.gz XYHKRYQCMBWYOI-NSHDSACASA-N 1 1 377.229 3.165 10 0 GGAEMO C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2CCOc3ccc(Br)cc32)CC[N@H+]1C ZINC000266833213 565092766 /nfs/dbraw/zinc/09/27/66/565092766.db2.gz ZQFQRFNXAUQALZ-XNRPHZJLSA-N 1 1 396.329 3.397 10 0 GGAEMO CC(C)[NH+]1CCN(C2CCN(Cc3ncc(C(F)(F)F)s3)CC2)CC1 ZINC000369482152 565093852 /nfs/dbraw/zinc/09/38/52/565093852.db2.gz NSNDGSXENLGLDS-UHFFFAOYSA-N 1 1 376.492 3.152 10 0 GGAEMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2Br)C[C@@]2(CCOC2)O1 ZINC000369545697 565096881 /nfs/dbraw/zinc/09/68/81/565096881.db2.gz JEZBJWLLYJKZMH-RDTXWAMCSA-N 1 1 397.313 3.048 10 0 GGAEMO C[N@H+]1CC[C@]2(CCN(CC(=O)Nc3ccc(Cl)cc3C(F)(F)F)C2)C1 ZINC000292083440 565097464 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COC(=O)c1ccc(C[NH2+][C@@H](CO)c2cccc(Br)c2)c(F)c1 ZINC000183891271 565101100 /nfs/dbraw/zinc/10/11/00/565101100.db2.gz OIOSTAUZDOHJDY-INIZCTEOSA-N 1 1 382.229 3.198 10 0 GGAEMO C[C@@H]1CCCC[C@@H]1N(C)C(=O)C[NH2+][C@@H](CO)c1cccc(Br)c1 ZINC000183896612 565101208 /nfs/dbraw/zinc/10/12/08/565101208.db2.gz XUTLAFSATFDUSS-COXVUDFISA-N 1 1 383.330 3.109 10 0 GGAEMO O=C(C[NH2+][C@@H](CO)c1cccc(Br)c1)NCc1cccc(Cl)c1 ZINC000183907293 565102472 /nfs/dbraw/zinc/10/24/72/565102472.db2.gz RGZFCNPIPGHSGR-INIZCTEOSA-N 1 1 397.700 3.042 10 0 GGAEMO CCc1nc(NC(=O)C[NH2+][C@@H](CO)c2cccc(Br)c2)sc1C ZINC000183904084 565103055 /nfs/dbraw/zinc/10/30/55/565103055.db2.gz CWWIJQRECYWZEM-AWEZNQCLSA-N 1 1 398.326 3.038 10 0 GGAEMO CCOc1ccccc1NC(=O)C[NH2+][C@H](CO)c1cccc(Br)c1 ZINC000183911321 565103066 /nfs/dbraw/zinc/10/30/66/565103066.db2.gz KHXLCXIKPZYSTK-MRXNPFEDSA-N 1 1 393.281 3.110 10 0 GGAEMO O=C(C[NH2+][C@H](CO)c1cccc(Br)c1)N1CCCc2ccccc21 ZINC000183910597 565103386 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C[N@H+]1CC[C@]2(CCN(Cc3nc(-c4cccc(Br)c4)no3)C2)C1 ZINC000292185583 565104047 /nfs/dbraw/zinc/10/40/47/565104047.db2.gz QWWIIUIXBNYERJ-KRWDZBQOSA-N 1 1 377.286 3.027 10 0 GGAEMO O=C(C[NH2+][C@H](CO)c1cccc(Br)c1)N(C1CC1)C1CCCC1 ZINC000183915415 565104312 /nfs/dbraw/zinc/10/43/12/565104312.db2.gz CWEZHYGXVGVBEC-QGZVFWFLSA-N 1 1 381.314 3.006 10 0 GGAEMO CCOC(=O)c1nc(CN2CC[NH+](Cc3ccc(CC)s3)CC2)cs1 ZINC000156803354 565106630 /nfs/dbraw/zinc/10/66/30/565106630.db2.gz XKDLQBHTCQWINT-UHFFFAOYSA-N 1 1 379.551 3.262 10 0 GGAEMO CS(=O)(=O)c1csc(C(=O)NCC2([NH+]3CCCCC3)CCCCC2)c1 ZINC000156848102 565107490 /nfs/dbraw/zinc/10/74/90/565107490.db2.gz IHDIIYIPMYAPJY-UHFFFAOYSA-N 1 1 384.567 3.070 10 0 GGAEMO O[C@H](CC1CCCC1)C[NH+]1CCC(O)(c2scnc2Br)CC1 ZINC000369703076 565107960 /nfs/dbraw/zinc/10/79/60/565107960.db2.gz LNVMYSPBRQOFPX-CYBMUJFWSA-N 1 1 389.359 3.130 10 0 GGAEMO C[N@H+]1CC[C@]2(CCN(CC(=O)Nc3ccc(Br)cc3Cl)C2)C1 ZINC000292259068 565108002 /nfs/dbraw/zinc/10/80/02/565108002.db2.gz 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Cc1n[nH]c([C@@H]2CCC[N@@H+](C[C@@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292774493 565132869 /nfs/dbraw/zinc/13/28/69/565132869.db2.gz KALLMIRCRCHBNX-SJKOYZFVSA-N 1 1 397.292 3.102 10 0 GGAEMO Cc1nc([C@@H]2CCC[N@H+](C[C@@](C)(O)c3ccc(Br)cc3F)C2)n[nH]1 ZINC000292774493 565132874 /nfs/dbraw/zinc/13/28/74/565132874.db2.gz KALLMIRCRCHBNX-SJKOYZFVSA-N 1 1 397.292 3.102 10 0 GGAEMO Cc1nc([C@@H]2CCC[N@@H+](C[C@@](C)(O)c3ccc(Br)cc3F)C2)n[nH]1 ZINC000292774493 565132877 /nfs/dbraw/zinc/13/28/77/565132877.db2.gz KALLMIRCRCHBNX-SJKOYZFVSA-N 1 1 397.292 3.102 10 0 GGAEMO Cn1cc(Br)c(CN2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)n1 ZINC000292810689 565135545 /nfs/dbraw/zinc/13/55/45/565135545.db2.gz CEBHZTURWHMCTR-CYBMUJFWSA-N 1 1 378.318 3.095 10 0 GGAEMO Cn1cc(Br)c(CN2CCC[C@H](c3[nH+]cc4n3CCCC4)C2)n1 ZINC000292810690 565135983 /nfs/dbraw/zinc/13/59/83/565135983.db2.gz CEBHZTURWHMCTR-ZDUSSCGKSA-N 1 1 378.318 3.095 10 0 GGAEMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1nn(C)cc1Br ZINC000292853463 565137921 /nfs/dbraw/zinc/13/79/21/565137921.db2.gz GIOYIAPBSQABMQ-RHSMWYFYSA-N 1 1 377.330 3.183 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1nn(C)cc1Br ZINC000292853468 565138636 /nfs/dbraw/zinc/13/86/36/565138636.db2.gz GIOYIAPBSQABMQ-WMLDXEAASA-N 1 1 377.330 3.183 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)C(=O)c2ccn(-c3ccc(Br)cc3)n2)CC[N@H+]1C ZINC000293050017 565147831 /nfs/dbraw/zinc/14/78/31/565147831.db2.gz AFYLBFOJJPGLJB-CJNGLKHVSA-N 1 1 391.313 3.190 10 0 GGAEMO C[C@H]1C[C@@H](N(C)C(=O)c2ccn(-c3ccc(Br)cc3)n2)CC[N@H+]1C ZINC000293050015 565147997 /nfs/dbraw/zinc/14/79/97/565147997.db2.gz AFYLBFOJJPGLJB-BBRMVZONSA-N 1 1 391.313 3.190 10 0 GGAEMO C[C@H]1C[C@H](N(C)C(=O)c2ccn(-c3ccc(Br)cc3)n2)CC[N@H+]1C ZINC000293050022 565148416 /nfs/dbraw/zinc/14/84/16/565148416.db2.gz AFYLBFOJJPGLJB-XJKSGUPXSA-N 1 1 391.313 3.190 10 0 GGAEMO OCC[N@H+](Cc1ccc(Cl)c(Cl)c1)C[C@H](O)COCc1ccccc1 ZINC000158131315 565157279 /nfs/dbraw/zinc/15/72/79/565157279.db2.gz WFAHGOFDPSKBQE-KRWDZBQOSA-N 1 1 384.303 3.365 10 0 GGAEMO CCOCCOc1ccc(Br)cc1C[NH2+][C@@H]1CCc2[nH]cnc2C1 ZINC000370730502 565158270 /nfs/dbraw/zinc/15/82/70/565158270.db2.gz OORCWTDTJFVVQG-OAHLLOKOSA-N 1 1 394.313 3.235 10 0 GGAEMO C[C@@H](c1cccc(S(N)(=O)=O)c1)[N@@H+](C)Cc1cccc(Br)c1 ZINC000158265900 565162515 /nfs/dbraw/zinc/16/25/15/565162515.db2.gz NDJWNVQKWUCJOF-LBPRGKRZSA-N 1 1 383.311 3.290 10 0 GGAEMO CN(CC[NH2+]Cc1csc(-c2ccccc2)n1)S(=O)(=O)c1cccs1 ZINC000158330153 565166367 /nfs/dbraw/zinc/16/63/67/565166367.db2.gz AUBADCOVOYPHJR-UHFFFAOYSA-N 1 1 393.559 3.282 10 0 GGAEMO Cc1c(Br)c2ccccc2n1CC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000370902992 565166844 /nfs/dbraw/zinc/16/68/44/565166844.db2.gz OMPCPRMUKQYBGN-GFCCVEGCSA-N 1 1 387.281 3.109 10 0 GGAEMO C[C@H]1C[C@@H](N(C)C(=O)Cc2c[nH]c3cc(Br)ccc23)CC[N@H+]1C ZINC000158450328 565169954 /nfs/dbraw/zinc/16/99/54/565169954.db2.gz ZDOQPQKSGQWRIG-WFASDCNBSA-N 1 1 378.314 3.414 10 0 GGAEMO CCn1cnnc1C1CC[NH+](C[C@H](O)c2ccc(F)c(Br)c2)CC1 ZINC000185006034 565170070 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CCC1(CC)C[N@H+](C[C@H](O)Cc2ccccc2C(F)(F)F)CC[S@@]1=O ZINC000185223473 565188502 /nfs/dbraw/zinc/18/85/02/565188502.db2.gz RVCHFMYLIISMOX-BZQUYTCOSA-N 1 1 377.472 3.232 10 0 GGAEMO CCC1(CC)C[N@@H+](C[C@H](O)Cc2ccccc2C(F)(F)F)CC[S@@]1=O ZINC000185223473 565188506 /nfs/dbraw/zinc/18/85/06/565188506.db2.gz RVCHFMYLIISMOX-BZQUYTCOSA-N 1 1 377.472 3.232 10 0 GGAEMO Cc1cccc(C(=O)N[C@@H]2C[N@@H+](C(C)C)C[C@@H]2C)c1I ZINC000158988624 565190470 /nfs/dbraw/zinc/19/04/70/565190470.db2.gz VVHUTANILOAXBV-GXTWGEPZSA-N 1 1 386.277 3.058 10 0 GGAEMO CCCCNC(=O)[C@@H]1CCC[N@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000159051102 565193326 /nfs/dbraw/zinc/19/33/26/565193326.db2.gz DFRVHFFDEVYSLB-CYBMUJFWSA-N 1 1 393.329 3.454 10 0 GGAEMO CCCCNC(=O)[C@@H]1CCC[N@@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000159051102 565193329 /nfs/dbraw/zinc/19/33/29/565193329.db2.gz DFRVHFFDEVYSLB-CYBMUJFWSA-N 1 1 393.329 3.454 10 0 GGAEMO O=C(NC[C@H](O)C[N@H+]1CCc2ccccc2C1)c1ccc(Cl)c(Cl)c1 ZINC000159167557 565196526 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CC[N@@H+](CC(=O)Nc1c(Cl)cccc1Cl)C[C@H](O)COC(C)(C)C ZINC000185490860 565204502 /nfs/dbraw/zinc/20/45/02/565204502.db2.gz MQBOHGONUDWKQH-LBPRGKRZSA-N 1 1 377.312 3.430 10 0 GGAEMO CC[N@H+](CC(=O)Nc1c(Cl)cccc1Cl)C[C@H](O)COC(C)(C)C ZINC000185490860 565204508 /nfs/dbraw/zinc/20/45/08/565204508.db2.gz MQBOHGONUDWKQH-LBPRGKRZSA-N 1 1 377.312 3.430 10 0 GGAEMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000371708961 565205782 /nfs/dbraw/zinc/20/57/82/565205782.db2.gz JYTHPSNQHYLHFG-CHWSQXEVSA-N 1 1 390.281 3.060 10 0 GGAEMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000371708963 565205915 /nfs/dbraw/zinc/20/59/15/565205915.db2.gz JYTHPSNQHYLHFG-QWHCGFSZSA-N 1 1 390.281 3.060 10 0 GGAEMO O[C@H](COC1CCOCC1)C[N@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000371715967 565207158 /nfs/dbraw/zinc/20/71/58/565207158.db2.gz MFJZYUHRZNVZDZ-JSGCOSHPSA-N 1 1 390.343 3.204 10 0 GGAEMO Cc1ccnc(C2CC[NH+](CC(=O)N(C)Cc3ccc(Cl)s3)CC2)n1 ZINC000371794506 565210569 /nfs/dbraw/zinc/21/05/69/565210569.db2.gz HDOBUSOESXLYFY-UHFFFAOYSA-N 1 1 378.929 3.338 10 0 GGAEMO Cc1ccnc(C2CC[NH+](C[C@H](O)c3cccc(Br)c3)CC2)n1 ZINC000371828457 565211941 /nfs/dbraw/zinc/21/19/41/565211941.db2.gz IPAAWIVYYBBEEJ-KRWDZBQOSA-N 1 1 376.298 3.461 10 0 GGAEMO C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CCC([N@@H+](C)CCCO)CC1 ZINC000270382253 565216664 /nfs/dbraw/zinc/21/66/64/565216664.db2.gz PLVZYJPAAOOKHH-ZDUSSCGKSA-N 1 1 389.323 3.066 10 0 GGAEMO COc1cc(Br)c(C(=O)NCC[N@H+]2CCCC[C@H]2C)cc1OC ZINC000294548142 565217493 /nfs/dbraw/zinc/21/74/93/565217493.db2.gz QTDIMWFTBVTSMC-GFCCVEGCSA-N 1 1 385.302 3.071 10 0 GGAEMO Nc1c(Br)cc(Br)cc1CN1CC[N@H+]2CCC[C@@H]2C1 ZINC000185720785 565218471 /nfs/dbraw/zinc/21/84/71/565218471.db2.gz HCHFGUZDBXZFGJ-GFCCVEGCSA-N 1 1 389.135 3.074 10 0 GGAEMO CC[N@H+]1CCC[C@H](NC(=O)c2cc(Br)ccc2Br)C1 ZINC000160454731 565245494 /nfs/dbraw/zinc/24/54/94/565245494.db2.gz NRRQRLDJBLTLAJ-NSHDSACASA-N 1 1 390.119 3.426 10 0 GGAEMO C[N@H+]1CC[C@@H](NC(=O)c2[nH]nc(C3CC3)c2Br)[C@H]1c1ccccc1 ZINC000270638786 565225416 /nfs/dbraw/zinc/22/54/16/565225416.db2.gz KLUBREIDXBBACM-CXAGYDPISA-N 1 1 389.297 3.225 10 0 GGAEMO CC[C@@H](Cc1ccccc1Br)[N@@H+](C)C[C@@H](C)CS(C)(=O)=O ZINC000185923295 565228754 /nfs/dbraw/zinc/22/87/54/565228754.db2.gz MRMBECHRMDQNHJ-HIFRSBDPSA-N 1 1 376.360 3.383 10 0 GGAEMO Cc1ccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(F)cc2)c(Br)n1 ZINC000372304182 565229788 /nfs/dbraw/zinc/22/97/88/565229788.db2.gz BNTWPDQVNIOXDT-CVEARBPZSA-N 1 1 392.272 3.467 10 0 GGAEMO Cc1ccc(C(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccc(F)cc2)c(Br)n1 ZINC000372304182 565229793 /nfs/dbraw/zinc/22/97/93/565229793.db2.gz BNTWPDQVNIOXDT-CVEARBPZSA-N 1 1 392.272 3.467 10 0 GGAEMO C[C@@H]1C[N@H+](CCCCNC(=O)Cc2cscc2Br)C[C@H](C)O1 ZINC000294856337 565231882 /nfs/dbraw/zinc/23/18/82/565231882.db2.gz GIQPJSMISUQIPY-BETUJISGSA-N 1 1 389.359 3.059 10 0 GGAEMO COc1cc(Br)c(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1OC ZINC000294876875 565233593 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C[C@H](CN[C@H](c1ccc(Br)cc1)c1cncnc1)[N@@H+](C)C1CC1 ZINC000186177691 565244851 /nfs/dbraw/zinc/24/48/51/565244851.db2.gz YLGDXGHEVCIOCK-FZKQIMNGSA-N 1 1 375.314 3.401 10 0 GGAEMO Cn1nc([C@H]2CCC[N@@H+]2CC/C=C/c2ccc(Br)cc2)nc1N ZINC000295140592 565246819 /nfs/dbraw/zinc/24/68/19/565246819.db2.gz DRPWOWGGXDGPEQ-FIMWJMCYSA-N 1 1 376.302 3.400 10 0 GGAEMO Cn1nc([C@H]2CCC[N@H+]2CC/C=C/c2ccc(Br)cc2)nc1N ZINC000295140592 565246824 /nfs/dbraw/zinc/24/68/24/565246824.db2.gz DRPWOWGGXDGPEQ-FIMWJMCYSA-N 1 1 376.302 3.400 10 0 GGAEMO O=S1(=O)CCC(C[N@@H+](Cc2cc(Br)ccc2F)C2CC2)CC1 ZINC000271324882 565248784 /nfs/dbraw/zinc/24/87/84/565248784.db2.gz UJMFLQNXWNAUPH-UHFFFAOYSA-N 1 1 390.318 3.377 10 0 GGAEMO O=S1(=O)CCC(C[N@H+](Cc2cc(Br)ccc2F)C2CC2)CC1 ZINC000271324882 565248787 /nfs/dbraw/zinc/24/87/87/565248787.db2.gz UJMFLQNXWNAUPH-UHFFFAOYSA-N 1 1 390.318 3.377 10 0 GGAEMO C[C@H](C[NH2+][C@@H]1CCc2c1ccc(F)c2Br)CN1CCN(C)CC1 ZINC000295174407 565249075 /nfs/dbraw/zinc/24/90/75/565249075.db2.gz LWJMRSRKVCOHNC-CXAGYDPISA-N 1 1 384.337 3.049 10 0 GGAEMO CN(C[C@H]1CC[N@@H+](C)C1)C(=O)c1cc(Br)ccc1Br ZINC000160549911 565250507 /nfs/dbraw/zinc/25/05/07/565250507.db2.gz VULBTCHIMXKOPN-JTQLQIEISA-N 1 1 390.119 3.235 10 0 GGAEMO C[C@H](CCN1CCN(C)CC1)[NH2+][C@@H]1CCc2c1ccc(F)c2Br ZINC000295423086 565264874 /nfs/dbraw/zinc/26/48/74/565264874.db2.gz OBDGNOHEMCXEBT-CXAGYDPISA-N 1 1 384.337 3.191 10 0 GGAEMO COC(=O)c1cc(NC(=O)N2CCC[N@H+](C(C)C)CC2)ccc1Br ZINC000271715016 565266056 /nfs/dbraw/zinc/26/60/56/565266056.db2.gz OZVDATQAECSOPC-UHFFFAOYSA-N 1 1 398.301 3.184 10 0 GGAEMO COC[C@H](C)OC[C@@H](O)C[N@H+]1CCC[C@@H]1c1ccc(Br)s1 ZINC000373181503 565274126 /nfs/dbraw/zinc/27/41/26/565274126.db2.gz UFXLQBXWZNRRBD-RWMBFGLXSA-N 1 1 378.332 3.060 10 0 GGAEMO COC[C@H](C)OC[C@H](O)C[N@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000373181504 565274218 /nfs/dbraw/zinc/27/42/18/565274218.db2.gz UFXLQBXWZNRRBD-XQQFMLRXSA-N 1 1 378.332 3.060 10 0 GGAEMO O=C(N[C@H]1CCC[N@H+](CCCO)C1)c1sc2ccccc2c1Br ZINC000295588844 565275055 /nfs/dbraw/zinc/27/50/55/565275055.db2.gz WIXKMUDIOXLZRY-LBPRGKRZSA-N 1 1 397.338 3.240 10 0 GGAEMO C[NH+](C)[C@@H]1CC[C@H]2[C@H](C1)OCCN2Cc1nc2ccc(Br)cc2[nH]1 ZINC000373451764 565286143 /nfs/dbraw/zinc/28/61/43/565286143.db2.gz HPJUXBNRQZVQNY-COXVUDFISA-N 1 1 393.329 3.009 10 0 GGAEMO COc1c(Br)cccc1C[N@@H+]1CCCC[C@@H]1CN1CCOCC1 ZINC000186931723 565296615 /nfs/dbraw/zinc/29/66/15/565296615.db2.gz HHASEGHDAUNAPY-MRXNPFEDSA-N 1 1 383.330 3.144 10 0 GGAEMO COc1c(Br)cccc1C[N@H+]1CCCC[C@@H]1CN1CCOCC1 ZINC000186931723 565296619 /nfs/dbraw/zinc/29/66/19/565296619.db2.gz HHASEGHDAUNAPY-MRXNPFEDSA-N 1 1 383.330 3.144 10 0 GGAEMO COc1c(Br)cccc1CN1CCCC[C@@H]1C[NH+]1CCOCC1 ZINC000186931723 565296621 /nfs/dbraw/zinc/29/66/21/565296621.db2.gz HHASEGHDAUNAPY-MRXNPFEDSA-N 1 1 383.330 3.144 10 0 GGAEMO C[C@@H](CC(=O)NCCCCN1CC[NH+](C)CC1)c1ccc(Br)cc1 ZINC000161901157 565297600 /nfs/dbraw/zinc/29/76/00/565297600.db2.gz DIJQPVSHDFEJDG-INIZCTEOSA-N 1 1 396.373 3.087 10 0 GGAEMO C[C@@H](NC(=O)N[C@H]1CCOc2ccc(Br)cc21)C1=CC[N@@H+](C)CC1 ZINC000272855934 565299527 /nfs/dbraw/zinc/29/95/27/565299527.db2.gz UPXYMQCEFHHMFU-WBMJQRKESA-N 1 1 394.313 3.222 10 0 GGAEMO CC[N@@H+]1CCC[C@H](NCc2cc(Br)cc(Br)c2N)C1 ZINC000187135886 565312222 /nfs/dbraw/zinc/31/22/22/565312222.db2.gz VEJJFHLHTJRSMU-LBPRGKRZSA-N 1 1 391.151 3.368 10 0 GGAEMO CC[N@H+]1CCC[C@H](NCc2cc(Br)cc(Br)c2N)C1 ZINC000187135886 565312224 /nfs/dbraw/zinc/31/22/24/565312224.db2.gz VEJJFHLHTJRSMU-LBPRGKRZSA-N 1 1 391.151 3.368 10 0 GGAEMO NC(=O)[C@@H]([NH2+]CCOCc1ccc(Cl)cc1)c1cccc(Br)c1 ZINC000162304927 565312433 /nfs/dbraw/zinc/31/24/33/565312433.db2.gz DPAQKPZDWRSWPN-INIZCTEOSA-N 1 1 397.700 3.435 10 0 GGAEMO Cn1cc[nH+]c1CC1CCN(C(=O)Cc2cc(Br)ccc2F)CC1 ZINC000162330761 565313572 /nfs/dbraw/zinc/31/35/72/565313572.db2.gz IMPZHLMQRFTPQC-UHFFFAOYSA-N 1 1 394.288 3.346 10 0 GGAEMO Cn1cc[nH+]c1CC1CCN(C(=O)c2cc(Br)ccc2F)CC1 ZINC000162345237 565314208 /nfs/dbraw/zinc/31/42/08/565314208.db2.gz VLXSYMGLDUSNRX-UHFFFAOYSA-N 1 1 380.261 3.417 10 0 GGAEMO COCC[N@H+]1CCN(Cc2cc(Br)cc3cccnc32)C[C@@H]1C ZINC000162559960 565320952 /nfs/dbraw/zinc/32/09/52/565320952.db2.gz SFFUOZVIBCEZFL-AWEZNQCLSA-N 1 1 378.314 3.150 10 0 GGAEMO Cn1cc[nH+]c1CC1CCN(C(=O)c2ccc(Br)cc2F)CC1 ZINC000162586063 565321924 /nfs/dbraw/zinc/32/19/24/565321924.db2.gz BZWXRPCAURAJAY-UHFFFAOYSA-N 1 1 380.261 3.417 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2cc(C)cc(Br)c2)[C@H](C)C1 ZINC000187337418 565324033 /nfs/dbraw/zinc/32/40/33/565324033.db2.gz HIAGHSKINUYQMN-CJNGLKHVSA-N 1 1 389.359 3.108 10 0 GGAEMO COc1cc(Br)ccc1CCC[N@H+]1CCC[C@@H]1[C@@H]1COCC[C@H]1O ZINC000374169336 565324170 /nfs/dbraw/zinc/32/41/70/565324170.db2.gz FDAHNEJUISANLQ-RCCFBDPRSA-N 1 1 398.341 3.252 10 0 GGAEMO Cc1cc(C)n2c(C[NH2+][C@@H]3COc4cc(F)c(Br)cc43)cnc2n1 ZINC000374209827 565325899 /nfs/dbraw/zinc/32/58/99/565325899.db2.gz JDCXSICFBHDVGZ-OAHLLOKOSA-N 1 1 391.244 3.471 10 0 GGAEMO Cc1cc(Br)cc(NC(=O)N2CCC([N@@H+]3CCO[C@H](C)C3)CC2)c1 ZINC000187479495 565334652 /nfs/dbraw/zinc/33/46/52/565334652.db2.gz YHZJBFCVGGCGBM-CQSZACIVSA-N 1 1 396.329 3.475 10 0 GGAEMO C[C@H]([NH2+][C@H](C(N)=O)c1ccc(Br)cc1F)[C@H]1COc2ccccc21 ZINC000163070753 565336189 /nfs/dbraw/zinc/33/61/89/565336189.db2.gz WJTFHDJZBMVRFN-IXBGWNDUSA-N 1 1 393.256 3.269 10 0 GGAEMO CS(=O)(=O)c1cccc(C[NH2+][C@H]2CCOc3c(Br)cccc32)c1 ZINC000296802154 565337357 /nfs/dbraw/zinc/33/73/57/565337357.db2.gz MRLULNIOZAUXQP-INIZCTEOSA-N 1 1 396.306 3.466 10 0 GGAEMO CC(C)n1cc(Br)cc1-c1nc([C@H]2C[N@H+]3CCC[C@H]3CO2)no1 ZINC000273853021 565340062 /nfs/dbraw/zinc/34/00/62/565340062.db2.gz CISFHVHUJOHYJF-GXTWGEPZSA-N 1 1 381.274 3.417 10 0 GGAEMO CC(C)n1cc(Br)cc1-c1nc([C@H]2C[N@H+]3CCC[C@@H]3CO2)no1 ZINC000273853030 565340440 /nfs/dbraw/zinc/34/04/40/565340440.db2.gz CISFHVHUJOHYJF-TZMCWYRMSA-N 1 1 381.274 3.417 10 0 GGAEMO COCC[N@@H+]1CCN(C(=O)Nc2cc(Br)c(C)cc2C)C[C@H]1C ZINC000187555126 565340624 /nfs/dbraw/zinc/34/06/24/565340624.db2.gz XRIDVMGMFLBJIC-CQSZACIVSA-N 1 1 384.318 3.250 10 0 GGAEMO COCC[N@H+]1CCN(C(=O)Nc2cc(Br)c(C)cc2C)C[C@H]1C ZINC000187555126 565340626 /nfs/dbraw/zinc/34/06/26/565340626.db2.gz XRIDVMGMFLBJIC-CQSZACIVSA-N 1 1 384.318 3.250 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)NC[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000163279808 565341694 /nfs/dbraw/zinc/34/16/94/565341694.db2.gz QNDSUKNBJNVBNV-OAHLLOKOSA-N 1 1 397.357 3.484 10 0 GGAEMO Cc1cc(C)c(NC(=O)N2C[C@H](C)[C@H]([NH+]3CCOCC3)C2)cc1Br ZINC000187568437 565341823 /nfs/dbraw/zinc/34/18/23/565341823.db2.gz YPOGYXRZALMXND-WMLDXEAASA-N 1 1 396.329 3.250 10 0 GGAEMO COc1nc(N2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)ncc1Br ZINC000374489050 565342384 /nfs/dbraw/zinc/34/23/84/565342384.db2.gz PYVZMZMFNXIUKU-GFCCVEGCSA-N 1 1 392.301 3.165 10 0 GGAEMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)NCc2ccc(Br)cc2OC)C1 ZINC000187600394 565344419 /nfs/dbraw/zinc/34/44/19/565344419.db2.gz MNQJLLOZNNKSRM-CQSZACIVSA-N 1 1 398.345 3.331 10 0 GGAEMO C[C@@H]1CN(Cc2csc(-c3cccc(Br)c3)n2)CC[N@H+]1CCO ZINC000187664610 565348145 /nfs/dbraw/zinc/34/81/45/565348145.db2.gz KOYVVHKTDZEMDO-CYBMUJFWSA-N 1 1 396.354 3.071 10 0 GGAEMO C[C@H]1CN(Cc2csc(-c3cccc(Br)c3)n2)CC[N@H+]1CCO ZINC000187664628 565348172 /nfs/dbraw/zinc/34/81/72/565348172.db2.gz KOYVVHKTDZEMDO-ZDUSSCGKSA-N 1 1 396.354 3.071 10 0 GGAEMO C[C@@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N1CC[N@H+](CCO)[C@H](C)C1 ZINC000187676496 565348927 /nfs/dbraw/zinc/34/89/27/565348927.db2.gz SVYOHAWFKGHXPI-NEPJUHHUSA-N 1 1 385.295 3.103 10 0 GGAEMO C[C@@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)N1CC[N@@H+](CCO)[C@H](C)C1 ZINC000187676496 565348930 /nfs/dbraw/zinc/34/89/30/565348930.db2.gz SVYOHAWFKGHXPI-NEPJUHHUSA-N 1 1 385.295 3.103 10 0 GGAEMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)N[C@H](c2nccs2)C(F)(F)F)C1 ZINC000297020055 565350610 /nfs/dbraw/zinc/35/06/10/565350610.db2.gz QJULXLXJOAPOGJ-QWHCGFSZSA-N 1 1 378.464 3.414 10 0 GGAEMO COCCC[C@@H]([NH2+]Cc1cc(C(N)=O)co1)c1ccc(Br)cc1 ZINC000187731238 565350999 /nfs/dbraw/zinc/35/09/99/565350999.db2.gz NKVLOSDORNBZJO-MRXNPFEDSA-N 1 1 381.270 3.399 10 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COc1cc(Br)ccc1CNC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000187843796 565358542 /nfs/dbraw/zinc/35/85/42/565358542.db2.gz ROCPTWWPAWYKHB-IUODEOHRSA-N 1 1 384.318 3.082 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2cc(Br)cc3cccnc32)C[C@@H]1N1CCOCC1 ZINC000164298277 565358977 /nfs/dbraw/zinc/35/89/77/565358977.db2.gz RLCIBAACGNEMLI-KSSFIOAISA-N 1 1 390.325 3.150 10 0 GGAEMO COc1cc(Br)ccc1CNC(=O)N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000187844863 565359451 /nfs/dbraw/zinc/35/94/51/565359451.db2.gz GGAKKHBHTJPQQI-HOCLYGCPSA-N 1 1 396.329 3.083 10 0 GGAEMO COc1cc(Br)ccc1CNC(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000187843874 565359614 /nfs/dbraw/zinc/35/96/14/565359614.db2.gz ROCPTWWPAWYKHB-WFASDCNBSA-N 1 1 384.318 3.082 10 0 GGAEMO C[C@@H]1CC[C@@](CO)([N@@H+](C)CCC(=O)Nc2ccc(Br)cc2F)C1 ZINC000187975440 565367559 /nfs/dbraw/zinc/36/75/59/565367559.db2.gz XQIKBLAXSBCLAO-SJKOYZFVSA-N 1 1 387.293 3.400 10 0 GGAEMO C[C@H]1C[C@H](N(C)C(=O)Nc2cnc(Cl)c(Br)c2)CC[N@H+]1C ZINC000274327932 565367764 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CC[N@H+]1CC[C@@H](NC(=O)c2cc(Br)sc2Br)C1 ZINC000389962975 565554618 /nfs/dbraw/zinc/55/46/18/565554618.db2.gz GEWPZUKGNOJCJE-SSDOTTSWSA-N 1 1 382.121 3.097 10 0 GGAEMO CC[N@H+]1CC[C@H](NC(=O)c2ccc(Br)cc2Br)C1 ZINC000390029432 565555109 /nfs/dbraw/zinc/55/51/09/565555109.db2.gz YKCUGVJWVRCXMR-JTQLQIEISA-N 1 1 376.092 3.036 10 0 GGAEMO C[C@@H](C[N@@H+](C)Cc1ccccc1)NS(=O)(=O)c1ccccc1Br ZINC000390733276 565557091 /nfs/dbraw/zinc/55/70/91/565557091.db2.gz ZITQVQUUIJMBCS-AWEZNQCLSA-N 1 1 397.338 3.248 10 0 GGAEMO C[C@@H]([NH2+]Cc1c(Br)cnn1C)c1ccc(NC(=O)NC2CC2)cc1 ZINC000278426665 565558136 /nfs/dbraw/zinc/55/81/36/565558136.db2.gz RLAGKWUHYGAFNG-LLVKDONJSA-N 1 1 392.301 3.317 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNc1ncc(Cn2cc(Br)cn2)s1 ZINC000302839529 565560629 /nfs/dbraw/zinc/56/06/29/565560629.db2.gz ZJCVRQPAJXEXPK-GFCCVEGCSA-N 1 1 384.347 3.437 10 0 GGAEMO CC[C@H]1Oc2cc([C@@H](C)[NH2+]Cc3c(Br)cnn3C)ccc2NC1=O ZINC000278488638 565562195 /nfs/dbraw/zinc/56/21/95/565562195.db2.gz LTGFHKSIBWOMHZ-MEBBXXQBSA-N 1 1 393.285 3.143 10 0 GGAEMO COc1ncc(Br)cc1CNc1cc[nH+]c(N2CCCCC2)n1 ZINC000624545747 565562785 /nfs/dbraw/zinc/56/27/85/565562785.db2.gz RUPREXFDGOEIHK-UHFFFAOYSA-N 1 1 378.274 3.245 10 0 GGAEMO Cn1ncc(Br)c1C[NH2+][C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000278514708 565563626 /nfs/dbraw/zinc/56/36/26/565563626.db2.gz PGSDVZSXAIGDAE-KRWDZBQOSA-N 1 1 378.270 3.195 10 0 GGAEMO C[C@@H](c1cccc(NCc2c(Br)cnn2C)c1)[NH+]1CCOCC1 ZINC000278538826 565564101 /nfs/dbraw/zinc/56/41/01/565564101.db2.gz SVBLBVAYAAXXOX-ZDUSSCGKSA-N 1 1 379.302 3.188 10 0 GGAEMO Cc1[nH+]ccn1-c1ccc(CNCc2c(Br)cnn2C)cc1F ZINC000278554850 565565826 /nfs/dbraw/zinc/56/58/26/565565826.db2.gz VMGNWPBGBPBMMH-UHFFFAOYSA-N 1 1 378.249 3.106 10 0 GGAEMO CC[N@@H+](CCNC(=O)Cn1c(C)c(Br)c2ccccc21)C1CC1 ZINC000303166434 565569056 /nfs/dbraw/zinc/56/90/56/565569056.db2.gz QIKURUWKDIGREI-UHFFFAOYSA-N 1 1 378.314 3.313 10 0 GGAEMO Cc1nc(C[C@H]2CCC[N@H+](Cc3ccc(I)cc3)C2)no1 ZINC000173646083 565573602 /nfs/dbraw/zinc/57/36/02/565573602.db2.gz DYWHWCGNJLOWFV-CQSZACIVSA-N 1 1 397.260 3.437 10 0 GGAEMO Cc1nc(C[C@H]2CCC[N@@H+](Cc3ccc(I)cc3)C2)no1 ZINC000173646083 565573608 /nfs/dbraw/zinc/57/36/08/565573608.db2.gz DYWHWCGNJLOWFV-CQSZACIVSA-N 1 1 397.260 3.437 10 0 GGAEMO CC[C@H](Cc1cccc(Br)c1)C(=O)NC[C@H]1CCC[N@H+]1CCOC ZINC000303679881 565573815 /nfs/dbraw/zinc/57/38/15/565573815.db2.gz MBOSZSXXNSTVQZ-SJLPKXTDSA-N 1 1 397.357 3.245 10 0 GGAEMO C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1ncc(-c2cccc(Br)c2)o1 ZINC000173660681 565574925 /nfs/dbraw/zinc/57/49/25/565574925.db2.gz WACHWZHZXKQZSM-DGCLKSJQSA-N 1 1 378.270 3.190 10 0 GGAEMO O[C@@H](C[NH2+]Cc1ncc(C(F)(F)F)s1)c1cc(Cl)c2c(c1)OCCO2 ZINC000278750645 565575194 /nfs/dbraw/zinc/57/51/94/565575194.db2.gz WGNZGCXOECFCBB-JTQLQIEISA-N 1 1 394.802 3.410 10 0 GGAEMO COCC[N@@H+]1CCN(Cc2ncc(-c3cccc(Br)c3)o2)C[C@@H]1C ZINC000173678556 565575663 /nfs/dbraw/zinc/57/56/63/565575663.db2.gz DCPFJVZYXNVALW-AWEZNQCLSA-N 1 1 394.313 3.257 10 0 GGAEMO COCC[N@H+]1CCN(Cc2ncc(-c3cccc(Br)c3)o2)C[C@@H]1C ZINC000173678556 565575665 /nfs/dbraw/zinc/57/56/65/565575665.db2.gz DCPFJVZYXNVALW-AWEZNQCLSA-N 1 1 394.313 3.257 10 0 GGAEMO COCC[N@@H+]1CCN(Cc2ncc(-c3ccc(Br)cc3)o2)C[C@@H]1C ZINC000173678384 565575954 /nfs/dbraw/zinc/57/59/54/565575954.db2.gz QXOZRIIMHGFJBS-AWEZNQCLSA-N 1 1 394.313 3.257 10 0 GGAEMO COCC[N@H+]1CCN(Cc2ncc(-c3ccc(Br)cc3)o2)C[C@@H]1C ZINC000173678384 565575956 /nfs/dbraw/zinc/57/59/56/565575956.db2.gz QXOZRIIMHGFJBS-AWEZNQCLSA-N 1 1 394.313 3.257 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)NCCC[N@H+]1CCCC[C@@H]1C ZINC000303943187 565576094 /nfs/dbraw/zinc/57/60/94/565576094.db2.gz GABMIKDEVICOGM-AWEZNQCLSA-N 1 1 383.330 3.381 10 0 GGAEMO Cn1ncc(NC[C@]2(C)CCC[N@H+]2Cc2ccccc2)c(Br)c1=O ZINC000397925718 565576326 /nfs/dbraw/zinc/57/63/26/565576326.db2.gz BMBRRYCVGPEQQL-SFHVURJKSA-N 1 1 391.313 3.009 10 0 GGAEMO Cn1ncc(NC[C@@]2(C)CCC[N@H+]2Cc2ccccc2)c(Br)c1=O ZINC000397925716 565576454 /nfs/dbraw/zinc/57/64/54/565576454.db2.gz BMBRRYCVGPEQQL-GOSISDBHSA-N 1 1 391.313 3.009 10 0 GGAEMO CC(C)[C@H](C[N@@H+](C)Cc1ccccc1)NCc1c(Br)cnn1C ZINC000397963106 565577055 /nfs/dbraw/zinc/57/70/55/565577055.db2.gz QFAWUQNFKQIUEC-KRWDZBQOSA-N 1 1 379.346 3.429 10 0 GGAEMO CC(C)[C@H](CN(C)Cc1ccccc1)[NH2+]Cc1c(Br)cnn1C ZINC000397963106 565577059 /nfs/dbraw/zinc/57/70/59/565577059.db2.gz QFAWUQNFKQIUEC-KRWDZBQOSA-N 1 1 379.346 3.429 10 0 GGAEMO CN(C(=O)c1cc(Br)cn1C)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309804416 565577553 /nfs/dbraw/zinc/57/75/53/565577553.db2.gz TUHMWVOXDQRZQQ-MRXNPFEDSA-N 1 1 376.298 3.134 10 0 GGAEMO Cc1nn(C)c(CN(C)[C@@H]2CC[N@@H+](Cc3ccccc3)C2)c1Br ZINC000309752466 565578036 /nfs/dbraw/zinc/57/80/36/565578036.db2.gz ZWSHYBRWDNNYKZ-MRXNPFEDSA-N 1 1 377.330 3.197 10 0 GGAEMO C[C@@H]([NH2+]C1COCCOC1)c1ccc(Br)cc1Br ZINC000311030955 565579029 /nfs/dbraw/zinc/57/90/29/565579029.db2.gz CVNZCVWTMRMQNB-SECBINFHSA-N 1 1 379.092 3.278 10 0 GGAEMO C[C@@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)[N@H+]1CC[C@]2(CNC(=O)C2)C1 ZINC000278833850 565579402 /nfs/dbraw/zinc/57/94/02/565579402.db2.gz IPIQRURKKQRXFV-BTDLBPIBSA-N 1 1 381.263 3.316 10 0 GGAEMO O=C(N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]12)c1cc(Br)c[nH]1 ZINC000310410289 565579599 /nfs/dbraw/zinc/57/95/99/565579599.db2.gz MGJRDEITRUUNBF-DJIMGWMZSA-N 1 1 388.309 3.418 10 0 GGAEMO Brc1cccnc1N1CCO[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]21 ZINC000404170417 565582953 /nfs/dbraw/zinc/58/29/53/565582953.db2.gz XOTKQUYJINJMDN-QZTJIDSGSA-N 1 1 388.309 3.324 10 0 GGAEMO Brc1cccnc1N1CCO[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]21 ZINC000404170421 565583080 /nfs/dbraw/zinc/58/30/80/565583080.db2.gz XOTKQUYJINJMDN-ROUUACIJSA-N 1 1 388.309 3.324 10 0 GGAEMO O=C(NCc1ccc(C[NH+]2CCOCC2)cc1)c1cscc1Br ZINC000404820994 565583912 /nfs/dbraw/zinc/58/39/12/565583912.db2.gz MVNLRELGGBPVBH-UHFFFAOYSA-N 1 1 395.322 3.273 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1nscc1Br ZINC000404858445 565584416 /nfs/dbraw/zinc/58/44/16/565584416.db2.gz TUICZOCZHRPXMJ-FZMZJTMJSA-N 1 1 380.311 3.156 10 0 GGAEMO C[C@@H]([NH2+]Cc1ccc(I)cc1)c1nnc2n1CCCCC2 ZINC000313739927 565584525 /nfs/dbraw/zinc/58/45/25/565584525.db2.gz AMJQXWSMRSSUSG-GFCCVEGCSA-N 1 1 396.276 3.460 10 0 GGAEMO CN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)c1nscc1Br ZINC000404820065 565584574 /nfs/dbraw/zinc/58/45/74/565584574.db2.gz MGLRSXRJELHRLJ-AWEZNQCLSA-N 1 1 394.338 3.500 10 0 GGAEMO C[N@@H+](CCNS(=O)(=O)c1c(Cl)cccc1Br)C1CCCC1 ZINC000314328322 565585513 /nfs/dbraw/zinc/58/55/13/565585513.db2.gz CVVHOAZESPEKBD-UHFFFAOYSA-N 1 1 395.750 3.255 10 0 GGAEMO C[C@@]1(NC(=O)c2nscc2Br)CC[N@@H+](Cc2ccccc2)C1 ZINC000406011607 565587060 /nfs/dbraw/zinc/58/70/60/565587060.db2.gz SUBOFNUIBWLKJQ-MRXNPFEDSA-N 1 1 380.311 3.300 10 0 GGAEMO O=C1C[C@@]2(CC[N@H+](Cc3csc(-c4cccc(Br)c4)n3)C2)CN1 ZINC000278973137 565587328 /nfs/dbraw/zinc/58/73/28/565587328.db2.gz YCELZQROBLGTPW-KRWDZBQOSA-N 1 1 392.322 3.285 10 0 GGAEMO O=C1C[C@]2(CC[N@H+](Cc3csc(-c4ccc(Br)cc4)n3)C2)CN1 ZINC000278971497 565587525 /nfs/dbraw/zinc/58/75/25/565587525.db2.gz XWGZDCYYFHKASS-QGZVFWFLSA-N 1 1 392.322 3.285 10 0 GGAEMO C[C@@H]([NH2+][C@@H]1CCCN(c2cnn(C)c2)C1=O)c1ccccc1Br ZINC000173807445 565588674 /nfs/dbraw/zinc/58/86/74/565588674.db2.gz JKDLDBFAFFVJPQ-MLGOLLRUSA-N 1 1 377.286 3.029 10 0 GGAEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1S(=O)(=O)c1ccc(C)cc1Br ZINC000173829618 565590660 /nfs/dbraw/zinc/59/06/60/565590660.db2.gz YYJSWMSYIRKFAL-ZIAGYGMSSA-N 1 1 387.343 3.005 10 0 GGAEMO O=C(c1cc(-c2ccc(Br)cc2)n[nH]1)N1CC[N@@H+]2CCCC[C@@H]2C1 ZINC000408023657 565591154 /nfs/dbraw/zinc/59/11/54/565591154.db2.gz UCPFCKFWWNBUGF-OAHLLOKOSA-N 1 1 389.297 3.150 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1S(=O)(=O)c1ccc(C)cc1Br ZINC000173841185 565592015 /nfs/dbraw/zinc/59/20/15/565592015.db2.gz KRGMALWVIBHEMC-CQSZACIVSA-N 1 1 398.326 3.116 10 0 GGAEMO CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)c2nc(Br)ccc2C)C1 ZINC000191262628 565592176 /nfs/dbraw/zinc/59/21/76/565592176.db2.gz AKGSZVGHZLCZPR-CYBMUJFWSA-N 1 1 377.286 3.389 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)Nc1cc(Cl)c(Cl)cc1OC ZINC000191267342 565592686 /nfs/dbraw/zinc/59/26/86/565592686.db2.gz RTDVPPPLDWVTJE-NSHDSACASA-N 1 1 376.284 3.234 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)N1CCC[N@H+](C2CCCC2)CC1 ZINC000173862349 565594540 /nfs/dbraw/zinc/59/45/40/565594540.db2.gz DXYGPLKIZPKTBU-UHFFFAOYSA-N 1 1 395.341 3.477 10 0 GGAEMO Brc1ccccc1-c1cnc(C[N@@H+]2CC[C@@H](N3CCOCC3)C2)o1 ZINC000173904969 565597746 /nfs/dbraw/zinc/59/77/46/565597746.db2.gz HCQJHCYOAOUOPQ-CQSZACIVSA-N 1 1 392.297 3.011 10 0 GGAEMO Brc1ccccc1-c1cnc(C[N@H+]2CC[C@@H](N3CCOCC3)C2)o1 ZINC000173904969 565597753 /nfs/dbraw/zinc/59/77/53/565597753.db2.gz HCQJHCYOAOUOPQ-CQSZACIVSA-N 1 1 392.297 3.011 10 0 GGAEMO Brc1ccc(-c2nc(C[N@@H+]3CC[C@@H](N4CCOCC4)C3)co2)cc1 ZINC000173904902 565598336 /nfs/dbraw/zinc/59/83/36/565598336.db2.gz DURRYFSUBLHOLT-QGZVFWFLSA-N 1 1 392.297 3.011 10 0 GGAEMO Brc1ccc(-c2nc(C[N@H+]3CC[C@@H](N4CCOCC4)C3)co2)cc1 ZINC000173904902 565598341 /nfs/dbraw/zinc/59/83/41/565598341.db2.gz 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380.579 3.082 10 0 GGAEMO CC[C@@H]1CN(C(=O)c2cc(Br)ccc2Cl)CC[N@H+]1C[C@@H](C)O ZINC000174604211 565646561 /nfs/dbraw/zinc/64/65/61/565646561.db2.gz WUJWUYYVABZAMX-DGCLKSJQSA-N 1 1 389.721 3.020 10 0 GGAEMO Cc1c(Br)ccc(C(=O)N2CC[N@@H+](C3CCOCC3)C[C@@H]2C)c1F ZINC000280044564 565648261 /nfs/dbraw/zinc/64/82/61/565648261.db2.gz GPYHKCWPSTYSKP-LBPRGKRZSA-N 1 1 399.304 3.222 10 0 GGAEMO CC[C@H]1CN(C(=O)c2cc(Cl)ccc2Br)CC[N@H+]1C[C@@H](C)O ZINC000174622529 565648574 /nfs/dbraw/zinc/64/85/74/565648574.db2.gz HFOCZYMKYVWMFM-YPMHNXCESA-N 1 1 389.721 3.020 10 0 GGAEMO CC[C@H]1CN(C(=O)c2ccc(Br)cc2Cl)CC[N@H+]1C[C@@H](C)O ZINC000174636782 565648796 /nfs/dbraw/zinc/64/87/96/565648796.db2.gz GCJDMSWQEXRHCT-YPMHNXCESA-N 1 1 389.721 3.020 10 0 GGAEMO CC[C@@H]1CN(C(=O)c2cc(Cl)ccc2Br)CC[N@H+]1C[C@@H](C)O ZINC000174622517 565648839 /nfs/dbraw/zinc/64/88/39/565648839.db2.gz HFOCZYMKYVWMFM-DGCLKSJQSA-N 1 1 389.721 3.020 10 0 GGAEMO Cc1cnc(CC[N@@H+](C)[C@H]2CCN(c3cccc(Br)c3)C2=O)s1 ZINC000192075285 565656678 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396.260 3.488 10 0 GGAEMO C[C@]12CCC[N@@H+]1C[C@@H](c1noc(Cc3ccc(Br)c(F)c3)n1)OC2 ZINC000329592735 565672843 /nfs/dbraw/zinc/67/28/43/565672843.db2.gz OERQWYKGEHYSAP-WMLDXEAASA-N 1 1 396.260 3.488 10 0 GGAEMO C[C@]12CCC[N@H+]1C[C@@H](c1noc(Cc3ccc(Br)c(F)c3)n1)OC2 ZINC000329592735 565672849 /nfs/dbraw/zinc/67/28/49/565672849.db2.gz OERQWYKGEHYSAP-WMLDXEAASA-N 1 1 396.260 3.488 10 0 GGAEMO CC[N@@H+](CC(=O)OC(C)(C)C)C1CCN(c2cncc(Br)c2)CC1 ZINC000192240635 565673235 /nfs/dbraw/zinc/67/32/35/565673235.db2.gz MNQGPSNHMWIMNE-UHFFFAOYSA-N 1 1 398.345 3.477 10 0 GGAEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)CCc1ccc(OC)c(Br)c1 ZINC000175020323 565674023 /nfs/dbraw/zinc/67/40/23/565674023.db2.gz YMCNLGZESILQDA-HZPDHXFCSA-N 1 1 395.341 3.476 10 0 GGAEMO C[C@@]12CCC[N@@H+]1C[C@@H](c1noc(Cc3cc(Br)ccc3F)n1)OC2 ZINC000329673278 565675093 /nfs/dbraw/zinc/67/50/93/565675093.db2.gz NXSPLWOLZUHMCF-YOEHRIQHSA-N 1 1 396.260 3.488 10 0 GGAEMO C[C@@]12CCC[N@H+]1C[C@@H](c1noc(Cc3cc(Br)ccc3F)n1)OC2 ZINC000329673278 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394.313 3.112 10 0 GGAEMO C[C@H](NC(=O)N(C)CC[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1Br ZINC000194808744 565839760 /nfs/dbraw/zinc/83/97/60/565839760.db2.gz PFZZEMCKAIWADS-ZNMIVQPWSA-N 1 1 398.345 3.261 10 0 GGAEMO C[C@H](NC(=O)N(C)CC[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1ccccc1Br ZINC000194808744 565839765 /nfs/dbraw/zinc/83/97/65/565839765.db2.gz PFZZEMCKAIWADS-ZNMIVQPWSA-N 1 1 398.345 3.261 10 0 GGAEMO C[C@@H]1C[C@@H]([NH+]2CCOCC2)CN1c1nccc2cc(Br)ccc21 ZINC000413275252 565843011 /nfs/dbraw/zinc/84/30/11/565843011.db2.gz AYDASVCSALNSNV-CZUORRHYSA-N 1 1 376.298 3.297 10 0 GGAEMO C[C@H](NC(=O)C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1ccc(Cl)cc1Cl ZINC000284370266 565851378 /nfs/dbraw/zinc/85/13/78/565851378.db2.gz LQGUSGPDBMNXPU-SGMGOOAPSA-N 1 1 386.323 3.112 10 0 GGAEMO C[C@H](NC(=O)C(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Cl)cc1Cl ZINC000284370223 565851568 /nfs/dbraw/zinc/85/15/68/565851568.db2.gz LQGUSGPDBMNXPU-DYEKYZERSA-N 1 1 386.323 3.112 10 0 GGAEMO NC(=O)[C@@H]([NH2+]CCc1cc(F)ccc1F)c1ccc(Br)cc1F ZINC000177470794 565854215 /nfs/dbraw/zinc/85/42/15/565854215.db2.gz LAPOUWAWMUFTHK-HNNXBMFYSA-N 1 1 387.199 3.225 10 0 GGAEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Nc1ccccc1I ZINC000177497852 565854718 /nfs/dbraw/zinc/85/47/18/565854718.db2.gz AXEYVBNABAOSEN-QWHCGFSZSA-N 1 1 399.276 3.382 10 0 GGAEMO O=C(c1cc2c(cc(Br)cc2F)[nH]1)N1CC[N@@H+]2CCCC[C@H]2C1 ZINC000195061020 565855522 /nfs/dbraw/zinc/85/55/22/565855522.db2.gz HXFDTVPWWWWKNL-LBPRGKRZSA-N 1 1 380.261 3.380 10 0 GGAEMO O=C(c1cc2c(cc(Br)cc2F)[nH]1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000195061020 565855526 /nfs/dbraw/zinc/85/55/26/565855526.db2.gz HXFDTVPWWWWKNL-LBPRGKRZSA-N 1 1 380.261 3.380 10 0 GGAEMO O=C(c1cnn(-c2ccc(Cl)cc2Cl)c1)N1CC[N@@H+]2CCCC[C@H]2C1 ZINC000195046769 565855751 /nfs/dbraw/zinc/85/57/51/565855751.db2.gz SGQQSQXASILQIS-HNNXBMFYSA-N 1 1 379.291 3.489 10 0 GGAEMO O=C(c1cnn(-c2ccc(Cl)cc2Cl)c1)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000195046769 565855754 /nfs/dbraw/zinc/85/57/54/565855754.db2.gz SGQQSQXASILQIS-HNNXBMFYSA-N 1 1 379.291 3.489 10 0 GGAEMO O=C(c1[nH]nc(-c2ccccc2)c1Br)N1CC[N@@H+]2CCCC[C@@H]2C1 ZINC000195045243 565856095 /nfs/dbraw/zinc/85/60/95/565856095.db2.gz YBRPVKJAEVIEIT-CQSZACIVSA-N 1 1 389.297 3.150 10 0 GGAEMO O=C(c1[nH]nc(-c2ccccc2)c1Br)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000195045243 565856098 /nfs/dbraw/zinc/85/60/98/565856098.db2.gz YBRPVKJAEVIEIT-CQSZACIVSA-N 1 1 389.297 3.150 10 0 GGAEMO C[C@H](C(=O)NC[C@@H]1CCC[N@@H+](C)[C@H]1c1ccnn1C)c1ccc(Cl)s1 ZINC000284526755 565857129 /nfs/dbraw/zinc/85/71/29/565857129.db2.gz GARDHTVNVCUELR-GDZNZVCISA-N 1 1 380.945 3.438 10 0 GGAEMO O=C(NCCCCF)NC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000413553374 565859225 /nfs/dbraw/zinc/85/92/25/565859225.db2.gz OULATUUFDBPRNS-UHFFFAOYSA-N 1 1 386.309 3.462 10 0 GGAEMO C[C@@H](F)CCNC(=O)NC1CC[NH+](Cc2cccc(Br)c2)CC1 ZINC000413570355 565860769 /nfs/dbraw/zinc/86/07/69/565860769.db2.gz OGVIVZITGNGOFO-CYBMUJFWSA-N 1 1 386.309 3.461 10 0 GGAEMO CC(C)Sc1c(Cl)cccc1NC(=O)C(=O)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000177698597 565867405 /nfs/dbraw/zinc/86/74/05/565867405.db2.gz MIIHNTOURGXDCN-CYBMUJFWSA-N 1 1 381.929 3.086 10 0 GGAEMO OCCn1nccc1C1CC[NH+](Cc2ccc(Br)c(F)c2)CC1 ZINC000177698363 565868214 /nfs/dbraw/zinc/86/82/14/565868214.db2.gz GCEZHVWBRCBHCE-UHFFFAOYSA-N 1 1 382.277 3.157 10 0 GGAEMO C[N@@H+](Cc1ccc(Br)c(F)c1)[C@H]1CCCN(c2cccnn2)C1 ZINC000177708688 565869295 /nfs/dbraw/zinc/86/92/95/565869295.db2.gz DXVDNMFKUODDJJ-AWEZNQCLSA-N 1 1 379.277 3.479 10 0 GGAEMO Cc1ccc(N2CCC[N@H+](Cc3cc(F)cc(Br)c3)CC2)nn1 ZINC000177708429 565869505 /nfs/dbraw/zinc/86/95/05/565869505.db2.gz PNBBZCACJACAKD-UHFFFAOYSA-N 1 1 379.277 3.399 10 0 GGAEMO Cc1ccc(N2CCC[N@@H+](Cc3cc(F)cc(Br)c3)CC2)nn1 ZINC000177708429 565869510 /nfs/dbraw/zinc/86/95/10/565869510.db2.gz PNBBZCACJACAKD-UHFFFAOYSA-N 1 1 379.277 3.399 10 0 GGAEMO C[C@H](C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1)C(=O)OC(C)(C)C ZINC000413732955 565870993 /nfs/dbraw/zinc/87/09/93/565870993.db2.gz CFLGFVRIGNFHOE-LLVKDONJSA-N 1 1 385.302 3.427 10 0 GGAEMO Cc1csc([C@@H]2CCC[N@@H+](CC(=O)N3CCC[C@H](C(F)(F)F)C3)C2)n1 ZINC000195337735 565877009 /nfs/dbraw/zinc/87/70/09/565877009.db2.gz OIHAZIKBYVFLMN-KGLIPLIRSA-N 1 1 375.460 3.432 10 0 GGAEMO Cc1[nH+]ccn1-c1ccc([C@H](C)NS(=O)(=O)CCc2cccs2)cc1 ZINC000195392951 565879030 /nfs/dbraw/zinc/87/90/30/565879030.db2.gz BCMHPKRRLPCBCJ-AWEZNQCLSA-N 1 1 375.519 3.465 10 0 GGAEMO Brc1cc(C[N@@H+]2CC[C@@H](Oc3cccnc3)C2)cc2c1OCO2 ZINC000177965822 565883658 /nfs/dbraw/zinc/88/36/58/565883658.db2.gz MJEXQKAXSLMGQR-CQSZACIVSA-N 1 1 377.238 3.226 10 0 GGAEMO Brc1cc(C[N@H+]2CC[C@@H](Oc3cccnc3)C2)cc2c1OCO2 ZINC000177965822 565883663 /nfs/dbraw/zinc/88/36/63/565883663.db2.gz MJEXQKAXSLMGQR-CQSZACIVSA-N 1 1 377.238 3.226 10 0 GGAEMO CO[C@@H]1COC[C@@H]1[NH2+][C@@H](C)c1ccc(Br)cc1Br ZINC000414174695 565900210 /nfs/dbraw/zinc/90/02/10/565900210.db2.gz AYGSEDPVMOKXOC-AQUOVQTQSA-N 1 1 379.092 3.276 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)C(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000177975480 565885307 /nfs/dbraw/zinc/88/53/07/565885307.db2.gz JRUBGQXUTMLFPR-OAHLLOKOSA-N 1 1 381.263 3.128 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)C(=O)Nc1cc(Cl)ccc1Cl ZINC000177978887 565885436 /nfs/dbraw/zinc/88/54/36/565885436.db2.gz PMPBTLNMDXDGPI-ZDUSSCGKSA-N 1 1 381.263 3.128 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)C(=O)Nc1cccc(Cl)c1Cl ZINC000177974026 565885665 /nfs/dbraw/zinc/88/56/65/565885665.db2.gz FTFSGAZELGQCNJ-LBPRGKRZSA-N 1 1 381.263 3.128 10 0 GGAEMO Cn1nccc1C1CC[NH+](CC(=O)Nc2ccc(Br)cc2)CC1 ZINC000195503810 565889521 /nfs/dbraw/zinc/88/95/21/565889521.db2.gz DQOCHKYYMAVTQS-UHFFFAOYSA-N 1 1 377.286 3.001 10 0 GGAEMO O[C@@H](COc1ccc(Br)c(F)c1)C[N@H+]1CCc2ccccc2C1 ZINC000200437683 565895010 /nfs/dbraw/zinc/89/50/10/565895010.db2.gz LXXJLRYGDXPPDB-OAHLLOKOSA-N 1 1 380.257 3.386 10 0 GGAEMO CS(=O)(=O)NCC1CC[NH+](Cc2nc(-c3ccccc3Cl)cs2)CC1 ZINC000285250990 565897037 /nfs/dbraw/zinc/89/70/37/565897037.db2.gz APUJIJOWEQJNFI-UHFFFAOYSA-N 1 1 399.969 3.225 10 0 GGAEMO CO[C@@H]1COC[C@@H]1[NH2+][C@H](C)c1ccc(Br)cc1Br ZINC000414174696 565900162 /nfs/dbraw/zinc/90/01/62/565900162.db2.gz AYGSEDPVMOKXOC-OXHMUOHRSA-N 1 1 379.092 3.276 10 0 GGAEMO CC[N@H+]1CC[C@H](CNC(=O)c2ccc(Br)cc2Br)C1 ZINC000218766625 565900942 /nfs/dbraw/zinc/90/09/42/565900942.db2.gz FBYAUVUOWCWPFR-SNVBAGLBSA-N 1 1 390.119 3.283 10 0 GGAEMO C[NH+](C)C1(CN[C@H]2CCCOc3ccc(Br)cc32)CCOCC1 ZINC000178224813 565906581 /nfs/dbraw/zinc/90/65/81/565906581.db2.gz ZBCAYRUTHYUWLE-INIZCTEOSA-N 1 1 383.330 3.363 10 0 GGAEMO Cc1nccn1C[C@H]1CCC[N@H+]1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000178300162 565911137 /nfs/dbraw/zinc/91/11/37/565911137.db2.gz UGSXXXSYJITOEJ-CABCVRRESA-N 1 1 384.307 3.403 10 0 GGAEMO Cc1nccn1C[C@@H]1CCC[N@H+]1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000178300146 565911300 /nfs/dbraw/zinc/91/13/00/565911300.db2.gz UGSXXXSYJITOEJ-GJZGRUSLSA-N 1 1 384.307 3.403 10 0 GGAEMO Cc1nccn1C[C@H]1CCC[N@H+]1CC(=O)Nc1ccc(Br)c(C)c1 ZINC000178303023 565912410 /nfs/dbraw/zinc/91/24/10/565912410.db2.gz MBRVHSRNAUAZPC-MRXNPFEDSA-N 1 1 391.313 3.366 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1CC(=O)Nc1ccccc1Br ZINC000178318894 565912431 /nfs/dbraw/zinc/91/24/31/565912431.db2.gz HWARPBTYRVUBNG-CQSZACIVSA-N 1 1 377.286 3.057 10 0 GGAEMO Cc1nccn1C[C@H]1CCC[N@@H+]1[C@@H](C)C(=O)Nc1cccc(Br)c1 ZINC000178311047 565912675 /nfs/dbraw/zinc/91/26/75/565912675.db2.gz NUKTYOULGOBBEG-SUMWQHHRSA-N 1 1 391.313 3.446 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1CC(=O)Nc1ccccc1Br ZINC000178318876 565912716 /nfs/dbraw/zinc/91/27/16/565912716.db2.gz HWARPBTYRVUBNG-AWEZNQCLSA-N 1 1 377.286 3.057 10 0 GGAEMO C[C@@H](CC(=O)NCC[N@@H+]1CCOC(C)(C)C1)c1ccc(Br)cc1 ZINC000178503999 565921884 /nfs/dbraw/zinc/92/18/84/565921884.db2.gz QDUNLVJQGQWYKU-AWEZNQCLSA-N 1 1 383.330 3.170 10 0 GGAEMO C[C@@H](CC(=O)NCC[N@H+]1CCOC(C)(C)C1)c1ccc(Br)cc1 ZINC000178503999 565921887 /nfs/dbraw/zinc/92/18/87/565921887.db2.gz QDUNLVJQGQWYKU-AWEZNQCLSA-N 1 1 383.330 3.170 10 0 GGAEMO NS(=O)(=O)c1ccc(C[NH2+]C2(c3ccccc3F)CC2)cc1Br ZINC000414392021 565922231 /nfs/dbraw/zinc/92/22/31/565922231.db2.gz LXVXBAYFXCUQHG-UHFFFAOYSA-N 1 1 399.285 3.015 10 0 GGAEMO O=C(Cc1c[nH]c2cc(Br)ccc12)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000178602410 565928073 /nfs/dbraw/zinc/92/80/73/565928073.db2.gz WRSYVAOUMROOSL-OAHLLOKOSA-N 1 1 376.298 3.170 10 0 GGAEMO COCC[NH+]1CCC(N[C@H]2CCCOc3ccc(Br)cc32)CC1 ZINC000178656457 565931695 /nfs/dbraw/zinc/93/16/95/565931695.db2.gz IYXXMZIIYMJWLG-KRWDZBQOSA-N 1 1 383.330 3.363 10 0 GGAEMO COC[C@@H](O)C[N@@H+](CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(C)C ZINC000178835002 565940362 /nfs/dbraw/zinc/94/03/62/565940362.db2.gz XKNDWIUVZAPHAW-LBPRGKRZSA-N 1 1 382.810 3.015 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2cc(Cl)ccc2C(F)(F)F)CC[N@H+]1C ZINC000286097178 565942207 /nfs/dbraw/zinc/94/22/07/565942207.db2.gz UNYBOMMDCSWUSE-PWSUYJOCSA-N 1 1 384.851 3.462 10 0 GGAEMO CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2ccc(C)nc2Br)C1 ZINC000178886334 565944341 /nfs/dbraw/zinc/94/43/41/565944341.db2.gz OWJDGKLWROZAQK-ZDUSSCGKSA-N 1 1 377.286 3.389 10 0 GGAEMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)Cc1csc(Cc2cccc(Cl)c2)n1 ZINC000178936809 565947494 /nfs/dbraw/zinc/94/74/94/565947494.db2.gz NXLDRTVRMZFAKI-OKILXGFUSA-N 1 1 377.941 3.481 10 0 GGAEMO CCOc1cc(C[N@@H+]2CCC[C@@](C)(C(=O)OC)C2)cc(Br)c1O ZINC000414556248 565948360 /nfs/dbraw/zinc/94/83/60/565948360.db2.gz JQWPZKSWOOFAON-QGZVFWFLSA-N 1 1 386.286 3.329 10 0 GGAEMO CCOc1cc(C[N@H+]2CCC[C@@](C)(C(=O)OC)C2)cc(Br)c1O ZINC000414556248 565948364 /nfs/dbraw/zinc/94/83/64/565948364.db2.gz JQWPZKSWOOFAON-QGZVFWFLSA-N 1 1 386.286 3.329 10 0 GGAEMO C[N@@H+]1CC[C@H](NS(=O)(=O)c2ccccc2Br)[C@@H]1c1ccccc1 ZINC000178946429 565948806 /nfs/dbraw/zinc/94/88/06/565948806.db2.gz FNJGAJMIUWIPEU-RDJZCZTQSA-N 1 1 395.322 3.173 10 0 GGAEMO C[N@H+]1CC[C@H](NS(=O)(=O)c2ccccc2Br)[C@@H]1c1ccccc1 ZINC000178946429 565948810 /nfs/dbraw/zinc/94/88/10/565948810.db2.gz FNJGAJMIUWIPEU-RDJZCZTQSA-N 1 1 395.322 3.173 10 0 GGAEMO CC(C)[N@@H+](Cc1nc(-c2ccc(Br)cc2)c[nH]1)C[C@@H]1CCC(=O)N1 ZINC000414565600 565949326 /nfs/dbraw/zinc/94/93/26/565949326.db2.gz ZBRDXVZCFHJZOD-HNNXBMFYSA-N 1 1 391.313 3.328 10 0 GGAEMO CC(C)[N@H+](Cc1nc(-c2ccc(Br)cc2)c[nH]1)C[C@@H]1CCC(=O)N1 ZINC000414565600 565949329 /nfs/dbraw/zinc/94/93/29/565949329.db2.gz ZBRDXVZCFHJZOD-HNNXBMFYSA-N 1 1 391.313 3.328 10 0 GGAEMO CC(C)[N@H+](Cc1ccnc2c(Br)cccc12)C[C@@H]1CCC(=O)N1 ZINC000414565665 565949735 /nfs/dbraw/zinc/94/97/35/565949735.db2.gz FCUHEJAOUMIKGE-AWEZNQCLSA-N 1 1 376.298 3.486 10 0 GGAEMO COC(=O)[C@H]1CSCC[N@@H+](Cc2cnc(CCc3ccccc3)s2)C1 ZINC000414598732 565950938 /nfs/dbraw/zinc/95/09/38/565950938.db2.gz YJTNVGJKPCAORX-MRXNPFEDSA-N 1 1 376.547 3.266 10 0 GGAEMO CCc1c(NC(=O)[C@@H]2CC[C@H]([NH3+])C2)[nH]nc1-c1ccc(Br)cc1 ZINC000237118277 565951909 /nfs/dbraw/zinc/95/19/09/565951909.db2.gz ZRCLFNVNUKBLTE-YPMHNXCESA-N 1 1 377.286 3.468 10 0 GGAEMO O=C([O-])C[N@H+](CC1CC1)C1CC([NH2+]Cc2cnc(-c3ccsc3)s2)C1 ZINC000414677239 565954369 /nfs/dbraw/zinc/95/43/69/565954369.db2.gz IDRDPSMEZVUFPE-UHFFFAOYSA-N 1 1 377.535 3.289 10 0 GGAEMO O=C([O-])C[N@@H+](CC1CC1)C1CC([NH2+]Cc2cnc(-c3ccsc3)s2)C1 ZINC000414677239 565954374 /nfs/dbraw/zinc/95/43/74/565954374.db2.gz IDRDPSMEZVUFPE-UHFFFAOYSA-N 1 1 377.535 3.289 10 0 GGAEMO CN(Cc1cc(Br)cs1)C(=O)C[NH+]1CCC(c2c[nH]cn2)CC1 ZINC000360017025 565955814 /nfs/dbraw/zinc/95/58/14/565955814.db2.gz CAFCSWQOAGIWFQ-UHFFFAOYSA-N 1 1 397.342 3.072 10 0 GGAEMO C[C@H]([NH2+][C@H]1COc2c1ccc(Cl)c2Cl)c1cccc(S(N)(=O)=O)c1 ZINC000360808641 565961736 /nfs/dbraw/zinc/96/17/36/565961736.db2.gz AKXQJXMFFXHGNT-XPTSAGLGSA-N 1 1 387.288 3.425 10 0 GGAEMO O=C(Cc1c[nH]c2cccc(Br)c12)N1CCC[N@H+](C2CC2)CC1 ZINC000179193888 565964357 /nfs/dbraw/zinc/96/43/57/565964357.db2.gz IVBJRKYPMBOSRK-UHFFFAOYSA-N 1 1 376.298 3.170 10 0 GGAEMO C[N@@H+]1CC[C@@H](NC(=O)c2cccnc2Br)[C@@H]1c1ccc(F)cc1 ZINC000361192653 565966325 /nfs/dbraw/zinc/96/63/25/565966325.db2.gz XAADMJMTQHQJMM-CABCVRRESA-N 1 1 378.245 3.158 10 0 GGAEMO C[N@H+]1CC[C@@H](NC(=O)c2cccnc2Br)[C@@H]1c1ccc(F)cc1 ZINC000361192653 565966327 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389.337 3.422 10 0 GGAEMO OC[C@H]1CN(Cc2ccccc2)CC[C@H]1[NH2+]Cc1ccccc1Br ZINC000252476800 566114408 /nfs/dbraw/zinc/11/44/08/566114408.db2.gz BWBCWGDOLIIYDN-UYAOXDASSA-N 1 1 389.337 3.422 10 0 GGAEMO O=C1[C@H]([N@@H+]2CCC[C@H](n3cncn3)C2)CCN1c1ccc(Cl)c(Cl)c1 ZINC000181101889 566114735 /nfs/dbraw/zinc/11/47/35/566114735.db2.gz JZOJFICZYXWNGO-XJKSGUPXSA-N 1 1 380.279 3.027 10 0 GGAEMO O=C1[C@H]([N@H+]2CCC[C@H](n3cncn3)C2)CCN1c1ccc(Cl)c(Cl)c1 ZINC000181101889 566114740 /nfs/dbraw/zinc/11/47/40/566114740.db2.gz JZOJFICZYXWNGO-XJKSGUPXSA-N 1 1 380.279 3.027 10 0 GGAEMO C[C@@H]1C[C@@H](O)C[C@H](C)[N@@H+]1C[C@@H](O)COc1ccc(Cl)cc1Br ZINC000253335858 566117217 /nfs/dbraw/zinc/11/72/17/566117217.db2.gz ATKXPQJIKRDZIF-ZMJPVWNMSA-N 1 1 392.721 3.076 10 0 GGAEMO O=C(Nc1ccc([S@](=O)C(F)(F)F)cc1)N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000365864031 566124119 /nfs/dbraw/zinc/12/41/19/566124119.db2.gz UBRQBOPEQHQPQZ-OCDDVZBJSA-N 1 1 375.416 3.062 10 0 GGAEMO 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/nfs/dbraw/zinc/12/67/38/566126738.db2.gz JDQPQTOXICAPGA-DOMZBBRYSA-N 1 1 385.245 3.381 10 0 GGAEMO Cc1nc2n(n1)CCC[C@H]2[NH2+][C@H](C)c1ccc(I)cc1 ZINC000181257894 566128232 /nfs/dbraw/zinc/12/82/32/566128232.db2.gz MZQRRMVFORMORL-QMTHXVAHSA-N 1 1 382.249 3.377 10 0 GGAEMO C[C@@](N)(C(=O)Nc1ccc2c(c1F)CC[NH2+]C2)c1ccc(Br)cc1 ZINC000261748204 566132428 /nfs/dbraw/zinc/13/24/28/566132428.db2.gz IVQFHFIGDUWAJI-SFHVURJKSA-N 1 1 392.272 3.047 10 0 GGAEMO Cn1cc([C@@H]2C[NH2+]CCN2C(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2Cl)cn1 ZINC000181323320 566132816 /nfs/dbraw/zinc/13/28/16/566132816.db2.gz ANOPOIPVJIXFDQ-VYDXJSESSA-N 1 1 379.291 3.004 10 0 GGAEMO C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)N1CC[NH2+]C[C@H]1c1cnn(C)c1 ZINC000181333856 566133379 /nfs/dbraw/zinc/13/33/79/566133379.db2.gz WRUIMEMCTGSXRD-SJCJKPOMSA-N 1 1 381.307 3.079 10 0 GGAEMO C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N1CC[NH2+]C[C@@H]1c1cnn(C)c1 ZINC000181333831 566133567 /nfs/dbraw/zinc/13/35/67/566133567.db2.gz WRUIMEMCTGSXRD-SJKOYZFVSA-N 1 1 381.307 3.079 10 0 GGAEMO Cn1ccnc1[C@@H]1C[NH2+]CCN1C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000261803286 566134608 /nfs/dbraw/zinc/13/46/08/566134608.db2.gz VXWXLWCXSYDTIT-IOASZLSFSA-N 1 1 379.291 3.004 10 0 GGAEMO O=C(CCc1cc(Br)cs1)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000261852738 566137452 /nfs/dbraw/zinc/13/74/52/566137452.db2.gz VNQRAGOPOIFIPB-HNNXBMFYSA-N 1 1 380.311 3.011 10 0 GGAEMO C[C@H](CCc1ccc(Br)cc1)NC(=O)N1CC[NH2+]C[C@](C)(F)C1 ZINC000417236436 566139294 /nfs/dbraw/zinc/13/92/94/566139294.db2.gz UFRCYBLRIZFPEK-DYVFJYSZSA-N 1 1 386.309 3.113 10 0 GGAEMO Cc1cc(C[C@@H](C)[NH2+][C@@H](C)CC(=O)Nc2ccc(Br)cc2)n[nH]1 ZINC000181423744 566139748 /nfs/dbraw/zinc/13/97/48/566139748.db2.gz OFQHFKZSRDLOHC-NEPJUHHUSA-N 1 1 379.302 3.419 10 0 GGAEMO Cn1cc([C@@H]2C[NH2+]CCN2C(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2Cl)cn1 ZINC000181408835 566139762 /nfs/dbraw/zinc/13/97/62/566139762.db2.gz XQBTZEFASJCIGM-YCPHGPKFSA-N 1 1 379.291 3.004 10 0 GGAEMO Cc1cc(C[C@@H](C)[NH2+][C@H](C)CC(=O)Nc2ccc(Br)cc2)n[nH]1 ZINC000181423780 566139941 /nfs/dbraw/zinc/13/99/41/566139941.db2.gz OFQHFKZSRDLOHC-VXGBXAGGSA-N 1 1 379.302 3.419 10 0 GGAEMO C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC000261970461 566142588 /nfs/dbraw/zinc/14/25/88/566142588.db2.gz NDOAKKNYOMCJLC-SJKOYZFVSA-N 1 1 380.275 3.329 10 0 GGAEMO O=C([C@@H]1C[C@@H]1c1cccc(Br)c1)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000262001244 566143088 /nfs/dbraw/zinc/14/30/88/566143088.db2.gz PXGBAVMMOOXNAA-KURKYZTESA-N 1 1 386.293 3.121 10 0 GGAEMO C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000262039455 566145451 /nfs/dbraw/zinc/14/54/51/566145451.db2.gz TXYUPJOKMQGYNF-WBMJQRKESA-N 1 1 380.275 3.329 10 0 GGAEMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)Cc1cccc(Br)c1 ZINC000262064787 566146062 /nfs/dbraw/zinc/14/60/62/566146062.db2.gz WFHHCJIAZUDXPP-QGZVFWFLSA-N 1 1 389.293 3.173 10 0 GGAEMO Cc1oc(-c2cccs2)nc1C[NH2+][C@@H](C)c1ccc(S(N)(=O)=O)cc1 ZINC000181565392 566148820 /nfs/dbraw/zinc/14/88/20/566148820.db2.gz DPKKNGYQTUUWGE-NSHDSACASA-N 1 1 377.491 3.210 10 0 GGAEMO CS(=O)(=O)CC[C@H]1CCCC[N@@H+]1Cc1cccc(OCC(F)(F)F)c1 ZINC000366375445 566148950 /nfs/dbraw/zinc/14/89/50/566148950.db2.gz JXQUAUYGGKDJBU-OAHLLOKOSA-N 1 1 379.444 3.417 10 0 GGAEMO CS(=O)(=O)CC[C@H]1CCCC[N@H+]1Cc1cccc(OCC(F)(F)F)c1 ZINC000366375445 566148959 /nfs/dbraw/zinc/14/89/59/566148959.db2.gz JXQUAUYGGKDJBU-OAHLLOKOSA-N 1 1 379.444 3.417 10 0 GGAEMO CS(=O)(=O)CC[C@@H]1CCCC[N@@H+]1Cc1cccc(OCC(F)(F)F)c1 ZINC000366375444 566149238 /nfs/dbraw/zinc/14/92/38/566149238.db2.gz JXQUAUYGGKDJBU-HNNXBMFYSA-N 1 1 379.444 3.417 10 0 GGAEMO CS(=O)(=O)CC[C@@H]1CCCC[N@H+]1Cc1cccc(OCC(F)(F)F)c1 ZINC000366375444 566149244 /nfs/dbraw/zinc/14/92/44/566149244.db2.gz JXQUAUYGGKDJBU-HNNXBMFYSA-N 1 1 379.444 3.417 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(C(=O)Cc2ccc(Br)c(F)c2)CC1 ZINC000366394127 566150169 /nfs/dbraw/zinc/15/01/69/566150169.db2.gz GAHBRACZMXCFIQ-UHFFFAOYSA-N 1 1 380.261 3.499 10 0 GGAEMO C[C@H]([NH2+]CC(=O)N1CCO[C@@H]2CCCC[C@@H]21)c1ccccc1Br ZINC000181566099 566150417 /nfs/dbraw/zinc/15/04/17/566150417.db2.gz HHMOZBNDGYOLCS-RRQGHBQHSA-N 1 1 381.314 3.270 10 0 GGAEMO C[C@H]([NH2+]Cc1c(F)cccc1Br)c1ccc(S(N)(=O)=O)cc1 ZINC000181566468 566150843 /nfs/dbraw/zinc/15/08/43/566150843.db2.gz XPDJYHKZCLEHLB-JTQLQIEISA-N 1 1 387.274 3.086 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(C(=O)Cc2cc(Br)ccc2F)CC1 ZINC000366424316 566151616 /nfs/dbraw/zinc/15/16/16/566151616.db2.gz YIVDXTWMORXLCF-UHFFFAOYSA-N 1 1 380.261 3.499 10 0 GGAEMO COC[C@H]([NH2+]CCS(=O)(=O)c1cccc(Br)c1)c1ccccc1 ZINC000181656264 566156261 /nfs/dbraw/zinc/15/62/61/566156261.db2.gz COXDWDBZDHKOFS-KRWDZBQOSA-N 1 1 398.322 3.200 10 0 GGAEMO CS(=O)(=O)c1ccc(NC2CC([NH+]3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000366551055 566157363 /nfs/dbraw/zinc/15/73/63/566157363.db2.gz ZSDNPEBHEZZBLO-UHFFFAOYSA-N 1 1 376.444 3.307 10 0 GGAEMO Cc1nc2ccccn2c(=O)c1CC[N@H+](C)Cc1ccc(Br)o1 ZINC000290108015 566157511 /nfs/dbraw/zinc/15/75/11/566157511.db2.gz XKEUNRFJWNCQTQ-UHFFFAOYSA-N 1 1 376.254 3.033 10 0 GGAEMO CCSc1nccnc1C(=O)NC[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000366579621 566159579 /nfs/dbraw/zinc/15/95/79/566159579.db2.gz KNMVSAOQLGMFAQ-CZUORRHYSA-N 1 1 376.551 3.463 10 0 GGAEMO C[N@H+]1CCC[C@H]2CN(S(=O)(=O)Cc3ccc(Cl)cc3Cl)CC[C@@H]21 ZINC000181707413 566160869 /nfs/dbraw/zinc/16/08/69/566160869.db2.gz YZXLVNSGTVNFNL-LRDDRELGSA-N 1 1 377.337 3.239 10 0 GGAEMO Brc1ccccc1-n1cc(CN2CCC(c3[nH]cc[nH+]3)CC2)nn1 ZINC000290357134 566168389 /nfs/dbraw/zinc/16/83/89/566168389.db2.gz GFUHMNCFQWMKEL-UHFFFAOYSA-N 1 1 387.285 3.133 10 0 GGAEMO Cn1cc(CN2CCC[N@@H+](CCCc3ccccc3Br)CC2)cn1 ZINC000181848319 566169587 /nfs/dbraw/zinc/16/95/87/566169587.db2.gz RCRMVTUJGMFUHE-UHFFFAOYSA-N 1 1 391.357 3.323 10 0 GGAEMO Cn1cc(C[N@@H+]2CCCN(CCCc3ccccc3Br)CC2)cn1 ZINC000181848319 566169595 /nfs/dbraw/zinc/16/95/95/566169595.db2.gz RCRMVTUJGMFUHE-UHFFFAOYSA-N 1 1 391.357 3.323 10 0 GGAEMO Cn1cc(C[N@H+]2CCCN(CCCc3ccccc3Br)CC2)cn1 ZINC000181848319 566169601 /nfs/dbraw/zinc/16/96/01/566169601.db2.gz RCRMVTUJGMFUHE-UHFFFAOYSA-N 1 1 391.357 3.323 10 0 GGAEMO COc1cc(Br)ccc1CCC[N@H+]1CCC[C@@H](Cn2cncn2)C1 ZINC000181885784 566170403 /nfs/dbraw/zinc/17/04/03/566170403.db2.gz ZAGXLXWGAQLLLT-OAHLLOKOSA-N 1 1 393.329 3.394 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)Cc2ccc(F)cc2I)CC[N@H+]1C ZINC000417770663 566173959 /nfs/dbraw/zinc/17/39/59/566173959.db2.gz CJOHUVJNBGKUTN-RISCZKNCSA-N 1 1 376.257 3.345 10 0 GGAEMO CC[C@@H](Cc1ccccc1Br)NC(=O)N1CC[NH2+]C[C@](C)(F)C1 ZINC000417882325 566177806 /nfs/dbraw/zinc/17/78/06/566177806.db2.gz GZYRETQHHOCFOC-YOEHRIQHSA-N 1 1 386.309 3.113 10 0 GGAEMO CC[C@H](Cc1ccccc1Br)NC(=O)N1CC[NH2+]C[C@@](C)(F)C1 ZINC000417882321 566177821 /nfs/dbraw/zinc/17/78/21/566177821.db2.gz GZYRETQHHOCFOC-RHSMWYFYSA-N 1 1 386.309 3.113 10 0 GGAEMO COc1ccc(C[N@@H+]2CCC[C@@H](c3ccnc(N)n3)C2)cc1Br ZINC000366970545 566179237 /nfs/dbraw/zinc/17/92/37/566179237.db2.gz SCCOTRWGVRRNBP-CYBMUJFWSA-N 1 1 377.286 3.040 10 0 GGAEMO COc1ccc(C[N@H+]2CCC[C@@H](c3ccnc(N)n3)C2)cc1Br ZINC000366970545 566179241 /nfs/dbraw/zinc/17/92/41/566179241.db2.gz SCCOTRWGVRRNBP-CYBMUJFWSA-N 1 1 377.286 3.040 10 0 GGAEMO COc1ccc(C[N@@H+]2CCC[C@H](c3ccnc(N)n3)C2)cc1Br ZINC000366970551 566179657 /nfs/dbraw/zinc/17/96/57/566179657.db2.gz SCCOTRWGVRRNBP-ZDUSSCGKSA-N 1 1 377.286 3.040 10 0 GGAEMO COc1ccc(C[N@H+]2CCC[C@H](c3ccnc(N)n3)C2)cc1Br ZINC000366970551 566179662 /nfs/dbraw/zinc/17/96/62/566179662.db2.gz SCCOTRWGVRRNBP-ZDUSSCGKSA-N 1 1 377.286 3.040 10 0 GGAEMO O=C(CC[N@H+]1CCCC[C@@H]1[C@@H]1CNC(=O)C1)Nc1cc(Cl)ccc1Cl ZINC000367020955 566181533 /nfs/dbraw/zinc/18/15/33/566181533.db2.gz ORLGHLMEJZJTMV-BLLLJJGKSA-N 1 1 384.307 3.313 10 0 GGAEMO COC(=O)c1ccc(Cl)c(C[NH2+][C@H](C)c2ccc(S(C)(=O)=O)cc2)c1 ZINC000182105981 566183965 /nfs/dbraw/zinc/18/39/65/566183965.db2.gz UKNUIEWFDUSOEI-GFCCVEGCSA-N 1 1 381.881 3.381 10 0 GGAEMO COc1cc(Br)ccc1C[N@@H+](C)[C@H]1CCCN(c2cccnn2)C1 ZINC000182170345 566186614 /nfs/dbraw/zinc/18/66/14/566186614.db2.gz RHECNNQNPJMGLN-INIZCTEOSA-N 1 1 391.313 3.349 10 0 GGAEMO COc1cc(Br)ccc1C[NH+]1CCC([C@@H](O)c2nccn2C)CC1 ZINC000182193358 566189688 /nfs/dbraw/zinc/18/96/88/566189688.db2.gz NTNMHLHMVORMDH-QGZVFWFLSA-N 1 1 394.313 3.137 10 0 GGAEMO Cc1csc(C2([NH2+][C@H]3CCCc4ccc(S(N)(=O)=O)cc43)CCC2)n1 ZINC000290805195 566190144 /nfs/dbraw/zinc/19/01/44/566190144.db2.gz VTVLVMPBIITTNU-INIZCTEOSA-N 1 1 377.535 3.145 10 0 GGAEMO Cc1csc(C2([NH2+][C@@H]3CCCc4ccc(S(N)(=O)=O)cc43)CCC2)n1 ZINC000290805208 566190179 /nfs/dbraw/zinc/19/01/79/566190179.db2.gz VTVLVMPBIITTNU-MRXNPFEDSA-N 1 1 377.535 3.145 10 0 GGAEMO Cn1cc2c(n1)CCC[C@@H]2[NH2+]Cc1ccc(F)cc1I ZINC000418044580 566192332 /nfs/dbraw/zinc/19/23/32/566192332.db2.gz MYBJYCUBVPELMG-AWEZNQCLSA-N 1 1 385.224 3.331 10 0 GGAEMO Cc1ccc(I)c(C(=O)NC[C@H](c2ccco2)[NH+](C)C)c1 ZINC000263708897 566194407 /nfs/dbraw/zinc/19/44/07/566194407.db2.gz UNLPCMUKIQMSNL-CQSZACIVSA-N 1 1 398.244 3.225 10 0 GGAEMO Cc1cc(C[C@H](C)[NH2+]Cc2c(Br)cncc2Br)n[nH]1 ZINC000290992035 566199755 /nfs/dbraw/zinc/19/97/55/566199755.db2.gz 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3.434 10 0 GGAEMO CC(C)C[NH+]1CCN(C(=O)c2cc3c(cncc3Br)s2)CC1 ZINC000648718954 566302996 /nfs/dbraw/zinc/30/29/96/566302996.db2.gz NFFKNKVOOUNMGE-UHFFFAOYSA-N 1 1 382.327 3.473 10 0 GGAEMO COc1cc([C@@H](C)[NH2+]Cc2ccncc2Br)ccc1OCCO ZINC000625283708 566303065 /nfs/dbraw/zinc/30/30/65/566303065.db2.gz CAJRKVWRZGVUIT-GFCCVEGCSA-N 1 1 381.270 3.075 10 0 GGAEMO C[N@@H+](CCNC(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12)C1CCCC1 ZINC000625294096 566303616 /nfs/dbraw/zinc/30/36/16/566303616.db2.gz CTEHIEMQZKITKC-CGTJXYLNSA-N 1 1 377.326 3.325 10 0 GGAEMO COc1ccc(S(=O)(=O)NCC[N@H+]2CCCC[C@@H]2C)c(Cl)c1Cl ZINC000462443236 566304620 /nfs/dbraw/zinc/30/46/20/566304620.db2.gz WUINEDPDZCWCGF-NSHDSACASA-N 1 1 381.325 3.155 10 0 GGAEMO [NH3+]CC12CCC(CC1)CN2C(=O)c1n[nH]c(-c2ccccc2)c1Br ZINC000575997996 566304713 /nfs/dbraw/zinc/30/47/13/566304713.db2.gz CSINSCYMAATLQE-UHFFFAOYSA-N 1 1 389.297 3.183 10 0 GGAEMO COc1cncc(C[NH+]2CCC(Oc3cccc(Br)c3)CC2)n1 ZINC000625325210 566305373 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C[C@@H](c1ccsc1)[NH+]1CCN(CC(=O)Nc2nc3c(s2)CCC3)CC1 ZINC000462469164 566308272 /nfs/dbraw/zinc/30/82/72/566308272.db2.gz VVKWKQKNHHRWPH-ZDUSSCGKSA-N 1 1 376.551 3.011 10 0 GGAEMO CN([C@H]1CC[N@@H+](C2CC2)C1)S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F ZINC000509476044 566308814 /nfs/dbraw/zinc/30/88/14/566308814.db2.gz APAIIGHGFRXMIR-LBPRGKRZSA-N 1 1 382.835 3.216 10 0 GGAEMO CN([C@H]1CC[N@H+](C2CC2)C1)S(=O)(=O)c1cc(Cl)ccc1C(F)(F)F ZINC000509476044 566308822 /nfs/dbraw/zinc/30/88/22/566308822.db2.gz APAIIGHGFRXMIR-LBPRGKRZSA-N 1 1 382.835 3.216 10 0 GGAEMO CCc1[nH+]ccn1[C@H](C)CC(=O)NCc1ccc(OC)c(Br)c1 ZINC000648760846 566309331 /nfs/dbraw/zinc/30/93/31/566309331.db2.gz QRJIHGVDKLCYNT-GFCCVEGCSA-N 1 1 380.286 3.484 10 0 GGAEMO CCCN(CC(F)(F)F)C(=O)CN1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000625336744 566309782 /nfs/dbraw/zinc/30/97/82/566309782.db2.gz KFPOUCULOHLZRP-AWEZNQCLSA-N 1 1 377.476 3.228 10 0 GGAEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)NCc1cc(Br)ccc1OC ZINC000648755887 566309846 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[NH3+]CC(F)(F)CC(=O)NCc1ccc(Br)cc1C(F)(F)F ZINC000576049057 566311615 /nfs/dbraw/zinc/31/16/15/566311615.db2.gz FTIONSPIYGCVIJ-UHFFFAOYSA-N 1 1 375.135 3.068 10 0 GGAEMO O[C@@H](C[N@@H+](Cc1cccc(Br)c1)C1CCOCC1)CC1(O)CCC1 ZINC000625364474 566313779 /nfs/dbraw/zinc/31/37/79/566313779.db2.gz HTXSRRKZASOPJQ-GOSISDBHSA-N 1 1 398.341 3.096 10 0 GGAEMO CCOC(=O)c1cccc(C[NH+]2CCC(n3cc(Br)cn3)CC2)n1 ZINC000600116943 566315560 /nfs/dbraw/zinc/31/55/60/566315560.db2.gz OWUOUPQQSIUOAY-UHFFFAOYSA-N 1 1 393.285 3.054 10 0 GGAEMO Cc1ccc(C[N@H+](CCc2cn(C)nn2)C[C@@H]2CCCO2)c(Br)c1 ZINC000625388048 566316100 /nfs/dbraw/zinc/31/61/00/566316100.db2.gz ATQJUIQYKBLBQS-KRWDZBQOSA-N 1 1 393.329 3.110 10 0 GGAEMO Cc1ccc(C[N@@H+](CCc2cn(C)nn2)C[C@@H]2CCCO2)c(Br)c1 ZINC000625388048 566316107 /nfs/dbraw/zinc/31/61/07/566316107.db2.gz ATQJUIQYKBLBQS-KRWDZBQOSA-N 1 1 393.329 3.110 10 0 GGAEMO C[C@@H]1C[NH+](C(C)(C)CNC(=O)N2CCc3sc(Cl)cc3C2)C[C@@H](C)O1 ZINC000576103148 566316406 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/nfs/dbraw/zinc/34/47/01/566344701.db2.gz UOJRVNGTNFFFKB-MJGOQNOKSA-N 1 1 387.321 3.453 10 0 GGAEMO CNS(=O)(=O)[C@@H]1CCC[N@H+](C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000576433146 566345052 /nfs/dbraw/zinc/34/50/52/566345052.db2.gz YCRWZWMHKJYNPG-RCBBPTIPSA-N 1 1 376.444 3.122 10 0 GGAEMO CNS(=O)(=O)[C@@H]1CCC[N@@H+](C/C(C)=C\c2cccc(C(F)(F)F)c2)C1 ZINC000576433146 566345058 /nfs/dbraw/zinc/34/50/58/566345058.db2.gz YCRWZWMHKJYNPG-RCBBPTIPSA-N 1 1 376.444 3.122 10 0 GGAEMO O=C1CCCN1CCC[N@@H+]1CCC[C@@H]1c1ccc(I)cc1 ZINC000536041673 566346209 /nfs/dbraw/zinc/34/62/09/566346209.db2.gz JYJHBAFIKPIROP-MRXNPFEDSA-N 1 1 398.288 3.441 10 0 GGAEMO O=C1CCCN1CCC[N@@H+]1CCC[C@H]1c1ccc(I)cc1 ZINC000536041669 566346739 /nfs/dbraw/zinc/34/67/39/566346739.db2.gz JYJHBAFIKPIROP-INIZCTEOSA-N 1 1 398.288 3.441 10 0 GGAEMO CNS(=O)(=O)CCC[N@@H+](C)[C@H](c1ccc(F)cc1)c1ccc(Cl)cc1 ZINC000482973689 566347721 /nfs/dbraw/zinc/34/77/21/566347721.db2.gz DXQGRXPMJOZRMA-SFHVURJKSA-N 1 1 384.904 3.440 10 0 GGAEMO CN(C(=O)c1cc2c(cc(Br)cc2F)[nH]1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000600572429 566348002 /nfs/dbraw/zinc/34/80/02/566348002.db2.gz RMRSCZCSCHWKSM-GFCCVEGCSA-N 1 1 380.261 3.378 10 0 GGAEMO CCn1c(-c2ccccc2Br)nnc1N1CC[N@@H+](CC)[C@@H](C)C1 ZINC000670110894 566349562 /nfs/dbraw/zinc/34/95/62/566349562.db2.gz RAAGBZMXLISCAN-ZDUSSCGKSA-N 1 1 378.318 3.258 10 0 GGAEMO COC(=O)[C@H](NC[C@@H]1CC[N@H+]1C1CCCC1)c1cccc(Br)c1 ZINC000600612975 566350605 /nfs/dbraw/zinc/35/06/05/566350605.db2.gz DGMMBWSINCVYBZ-DLBZAZTESA-N 1 1 381.314 3.270 10 0 GGAEMO COC(=O)CCCN1CCC([NH2+][C@H]2COc3c2ccc(Cl)c3Cl)CC1 ZINC000462774454 566350597 /nfs/dbraw/zinc/35/05/97/566350597.db2.gz CMJFLSUDHCNEGG-HNNXBMFYSA-N 1 1 387.307 3.434 10 0 GGAEMO O=C([C@@H]1C[N@H+]2CCN1CCC2)N1CCC(c2cccc(Cl)c2Cl)CC1 ZINC000462771555 566351600 /nfs/dbraw/zinc/35/16/00/566351600.db2.gz FWACELFVLFQEET-KRWDZBQOSA-N 1 1 382.335 3.089 10 0 GGAEMO C[C@@H](C[N@H+]1CC[C@H](Sc2ccc(Br)cc2)C1)CS(C)(=O)=O ZINC000625703378 566352296 /nfs/dbraw/zinc/35/22/96/566352296.db2.gz FXGOKCMRRSMNLX-WFASDCNBSA-N 1 1 392.384 3.296 10 0 GGAEMO C[C@@H](C[N@H+]1CC[C@@H](Sc2ccc(Br)cc2)C1)CS(C)(=O)=O ZINC000625703376 566353092 /nfs/dbraw/zinc/35/30/92/566353092.db2.gz FXGOKCMRRSMNLX-SWLSCSKDSA-N 1 1 392.384 3.296 10 0 GGAEMO CNS(=O)(=O)c1ccc(C[NH2+]C(C)(C)c2nc3ccccc3s2)cc1 ZINC000625720266 566354512 /nfs/dbraw/zinc/35/45/12/566354512.db2.gz PLAUIEIHABQHJD-UHFFFAOYSA-N 1 1 375.519 3.229 10 0 GGAEMO CC(C)C[N@H+](Cc1ccc(F)c(Cl)c1)C[C@H]1CCN(S(C)(=O)=O)C1 ZINC000625720445 566355061 /nfs/dbraw/zinc/35/50/61/566355061.db2.gz ZSFSMEZLTOWWRU-OAHLLOKOSA-N 1 1 376.925 3.219 10 0 GGAEMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)[C@H]1[C@@H]2c3cccc(Br)c3C[C@H]12 ZINC000625753387 566355507 /nfs/dbraw/zinc/35/55/07/566355507.db2.gz YVJZGAANKFRBPA-DZJNRPSUSA-N 1 1 377.326 3.133 10 0 GGAEMO CC(C)[C@@H]1C[N@@H+](C)CCN1C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000625753389 566356129 /nfs/dbraw/zinc/35/61/29/566356129.db2.gz YVJZGAANKFRBPA-LAVFITLUSA-N 1 1 377.326 3.133 10 0 GGAEMO O=S(=O)(CC[N@@H+]1CC[C@H]2CC[C@@H](C1)S2)c1ccc(Br)cc1 ZINC000625770997 566357819 /nfs/dbraw/zinc/35/78/19/566357819.db2.gz BCBRERFILMLNBR-KGLIPLIRSA-N 1 1 390.368 3.193 10 0 GGAEMO O=S(=O)(CC[N@H+]1CC[C@H]2CC[C@@H](C1)S2)c1ccc(Br)cc1 ZINC000625770997 566357823 /nfs/dbraw/zinc/35/78/23/566357823.db2.gz BCBRERFILMLNBR-KGLIPLIRSA-N 1 1 390.368 3.193 10 0 GGAEMO CCCCc1noc(C[NH2+][C@]2(CO)CCc3cc(Br)ccc3C2)n1 ZINC000625795626 566358683 /nfs/dbraw/zinc/35/86/83/566358683.db2.gz XVYILOURTIMVPH-GOSISDBHSA-N 1 1 394.313 3.184 10 0 GGAEMO COc1cc(Br)ccc1[C@H]1CCC[N@@H+]1CCn1ccccc1=O ZINC000625793185 566358909 /nfs/dbraw/zinc/35/89/09/566358909.db2.gz QTCKONHUJFENGB-MRXNPFEDSA-N 1 1 377.282 3.457 10 0 GGAEMO COc1cc(Br)ccc1[C@H]1CCC[N@H+]1CCn1ccccc1=O ZINC000625793185 566358916 /nfs/dbraw/zinc/35/89/16/566358916.db2.gz QTCKONHUJFENGB-MRXNPFEDSA-N 1 1 377.282 3.457 10 0 GGAEMO CC(C)(C)c1noc(C[NH2+][C@@]2(CO)CCc3cc(Br)ccc3C2)n1 ZINC000625794257 566359012 /nfs/dbraw/zinc/35/90/12/566359012.db2.gz FJGDBAATLSRLNU-SFHVURJKSA-N 1 1 394.313 3.139 10 0 GGAEMO COc1cc(Br)ccc1[C@H]1CCCN1C[C@H](O)C[N@@H+](C)C(C)C ZINC000625795816 566359742 /nfs/dbraw/zinc/35/97/42/566359742.db2.gz YQLYHJBLMSHJND-NVXWUHKLSA-N 1 1 385.346 3.296 10 0 GGAEMO COc1cc(Br)ccc1[C@@H]1CCCN1C[C@@H](O)C[N@@H+](C)C(C)C ZINC000625795817 566359850 /nfs/dbraw/zinc/35/98/50/566359850.db2.gz YQLYHJBLMSHJND-RDJZCZTQSA-N 1 1 385.346 3.296 10 0 GGAEMO Cn1nc2c(c1C[NH2+]Cc1cc3c(cc1Br)OCO3)CCCC2 ZINC000462857458 566360026 /nfs/dbraw/zinc/36/00/26/566360026.db2.gz IAGVEENJDVXAOD-UHFFFAOYSA-N 1 1 378.270 3.080 10 0 GGAEMO COc1cc(Br)ccc1[C@@H]1CCCN1C[C@@H](O)C[N@@H+](C)C1CC1 ZINC000625794391 566359981 /nfs/dbraw/zinc/35/99/81/566359981.db2.gz JJCMKUZSPSNYMJ-RDJZCZTQSA-N 1 1 383.330 3.050 10 0 GGAEMO C[C@@H]1C[C@H](N(C)C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)CC[N@H+]1C ZINC000625803125 566360617 /nfs/dbraw/zinc/36/06/17/566360617.db2.gz GBSVRBJMGKNHBG-FGYYNUPOSA-N 1 1 377.326 3.276 10 0 GGAEMO C[C@@H]1C[C@H](N(C)C(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)CC[N@H+]1C ZINC000625803129 566361054 /nfs/dbraw/zinc/36/10/54/566361054.db2.gz GBSVRBJMGKNHBG-NIIBRFEOSA-N 1 1 377.326 3.276 10 0 GGAEMO COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)C[N@H+]1CC[C@H](C)C1 ZINC000576595847 566361600 /nfs/dbraw/zinc/36/16/00/566361600.db2.gz PZSBDDYPPIBNET-BBRMVZONSA-N 1 1 381.314 3.463 10 0 GGAEMO COc1cc(Br)c(C[NH2+]Cc2c3c(nn2C)CCCC3)cc1OC ZINC000462868862 566362838 /nfs/dbraw/zinc/36/28/38/566362838.db2.gz SURYVBMUMLBTPL-UHFFFAOYSA-N 1 1 394.313 3.368 10 0 GGAEMO O=C(NC[C@@H]1C[N@H+]2CCN1CCC2)c1ccc(-c2ccc(Cl)cc2)s1 ZINC000670446698 566363023 /nfs/dbraw/zinc/36/30/23/566363023.db2.gz AGYNBWDLJLRUEE-MRXNPFEDSA-N 1 1 375.925 3.188 10 0 GGAEMO C[N@@H+](CCCOc1cccc(I)c1)[C@@H]1CCCOC1 ZINC000510077389 566363893 /nfs/dbraw/zinc/36/38/93/566363893.db2.gz CPMMMYGMKBDPJH-CQSZACIVSA-N 1 1 375.250 3.171 10 0 GGAEMO Cc1ccc(C[N@@H+](CCO)CCC(=O)Nc2ccc(Br)cc2)o1 ZINC000483204047 566364251 /nfs/dbraw/zinc/36/42/51/566364251.db2.gz RVNITPSNQZEYEJ-UHFFFAOYSA-N 1 1 381.270 3.174 10 0 GGAEMO CC[C@H]1C[N@@H+](CCOc2cc(F)cc(Br)c2)C[C@]2(CCOC2)O1 ZINC000483200886 566364545 /nfs/dbraw/zinc/36/45/45/566364545.db2.gz QRSCVPKQLBGORL-RDJZCZTQSA-N 1 1 388.277 3.237 10 0 GGAEMO O=C(Cc1ccc(Br)s1)N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000510138645 566366706 /nfs/dbraw/zinc/36/67/06/566366706.db2.gz FYESLAWACDCPTN-AWEZNQCLSA-N 1 1 379.323 3.444 10 0 GGAEMO Cc1c(Cl)c(C[NH2+]C(C)(C)COc2ncccc2Br)nn1C ZINC000421346499 566366944 /nfs/dbraw/zinc/36/69/44/566366944.db2.gz ZAELDYRSBZTKJL-UHFFFAOYSA-N 1 1 387.709 3.487 10 0 GGAEMO COc1cc(Cl)c(C)cc1NC(=O)CC[NH2+]Cc1nn(C)c(C)c1Cl ZINC000421362992 566368642 /nfs/dbraw/zinc/36/86/42/566368642.db2.gz KKXYQYVJPZQVDQ-UHFFFAOYSA-N 1 1 385.295 3.471 10 0 GGAEMO C[N@@H+](CC(=O)N1CCC[C@@H]1c1ccccc1I)C1CCC1 ZINC000600817787 566368722 /nfs/dbraw/zinc/36/87/22/566368722.db2.gz SXICDXBSODYJCB-MRXNPFEDSA-N 1 1 398.288 3.439 10 0 GGAEMO COc1cc(C[N@@H+]2C[C@@H](O)CC[C@@H]2C)cc(Br)c1OC(F)F ZINC000421371354 566368874 /nfs/dbraw/zinc/36/88/74/566368874.db2.gz JQURGTKARCOZOO-ONGXEEELSA-N 1 1 380.229 3.404 10 0 GGAEMO COc1cc(C[N@H+]2C[C@@H](O)CC[C@@H]2C)cc(Br)c1OC(F)F ZINC000421371354 566368877 /nfs/dbraw/zinc/36/88/77/566368877.db2.gz JQURGTKARCOZOO-ONGXEEELSA-N 1 1 380.229 3.404 10 0 GGAEMO C[C@H]1OCC[C@H]1[N@@H+](CCO)Cc1cc(Br)ccc1OC(F)F ZINC000483269261 566369609 /nfs/dbraw/zinc/36/96/09/566369609.db2.gz RHCPCFKSLDWXRF-ZWNOBZJWSA-N 1 1 380.229 3.022 10 0 GGAEMO C[N@@H+](CC(=O)NCc1ccc(I)cc1Cl)C1CCC1 ZINC000600824401 566369929 /nfs/dbraw/zinc/36/99/29/566369929.db2.gz AXQONBXOSTXGAG-UHFFFAOYSA-N 1 1 392.668 3.045 10 0 GGAEMO C[C@H](N[C@@H]1C[N@@H+](C2CC2)C[C@@H]1C)c1ccc(Br)cc1OCCCO ZINC000462951979 566370850 /nfs/dbraw/zinc/37/08/50/566370850.db2.gz HOIPLXUXUQMBAJ-SUNYJGFJSA-N 1 1 397.357 3.344 10 0 GGAEMO C[C@H](N[C@@H]1C[N@H+](C2CC2)C[C@@H]1C)c1ccc(Br)cc1OCCCO ZINC000462951979 566370860 /nfs/dbraw/zinc/37/08/60/566370860.db2.gz HOIPLXUXUQMBAJ-SUNYJGFJSA-N 1 1 397.357 3.344 10 0 GGAEMO CCCC[N@@H+](C)CCNS(=O)(=O)c1c(Cl)cccc1Br ZINC000510220644 566371089 /nfs/dbraw/zinc/37/10/89/566371089.db2.gz BVDJCGIWYRSFHY-UHFFFAOYSA-N 1 1 383.739 3.113 10 0 GGAEMO C[C@@H]1OCC[C@@H]1[N@H+](CCO)Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000483292442 566371119 /nfs/dbraw/zinc/37/11/19/566371119.db2.gz GDKNQHUGSCWGCQ-WFASDCNBSA-N 1 1 381.270 3.076 10 0 GGAEMO C[C@@H]1OCC[C@@H]1[N@@H+](CCO)Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000483292442 566371125 /nfs/dbraw/zinc/37/11/25/566371125.db2.gz GDKNQHUGSCWGCQ-WFASDCNBSA-N 1 1 381.270 3.076 10 0 GGAEMO Cc1c(Cl)cc(F)c(NC(=O)NCCCC[N@H+]2CCC[C@H]2CO)c1F ZINC000536421795 566371512 /nfs/dbraw/zinc/37/15/12/566371512.db2.gz RRDNZTFEWXWCAC-LBPRGKRZSA-N 1 1 375.847 3.285 10 0 GGAEMO C[C@@H]1OCC[C@@H]1[N@H+](CCO)Cc1coc(-c2ccc(Br)cc2)n1 ZINC000483290991 566371895 /nfs/dbraw/zinc/37/18/95/566371895.db2.gz JAEZPKBHCSLUCV-LRDDRELGSA-N 1 1 381.270 3.076 10 0 GGAEMO C[C@@H]1OCC[C@@H]1[N@@H+](CCO)Cc1coc(-c2ccc(Br)cc2)n1 ZINC000483290991 566371899 /nfs/dbraw/zinc/37/18/99/566371899.db2.gz JAEZPKBHCSLUCV-LRDDRELGSA-N 1 1 381.270 3.076 10 0 GGAEMO Cc1n[nH]c(C)c1NC(=O)C[NH2+][C@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000625983663 566372577 /nfs/dbraw/zinc/37/25/77/566372577.db2.gz XBXQOWLUHKFPST-OAHLLOKOSA-N 1 1 384.311 3.164 10 0 GGAEMO CN(C)C[C@@H]([NH2+]CC(=O)N(C)c1nccs1)c1ccc(Cl)c(Cl)c1 ZINC000625983724 566373125 /nfs/dbraw/zinc/37/31/25/566373125.db2.gz YVUOEUVXPWUMFN-CQSZACIVSA-N 1 1 387.336 3.305 10 0 GGAEMO Cc1cc(Br)ccc1[C@@H]1CCC[N@H+]1C[C@H](O)COC[C@H]1CCCO1 ZINC000626009183 566373896 /nfs/dbraw/zinc/37/38/96/566373896.db2.gz ANDLJYOCQYIGTQ-SCTDSRPQSA-N 1 1 398.341 3.451 10 0 GGAEMO COCCOC[C@@H](O)C[N@@H+]1CCC[C@H]1c1ccc(Br)cc1Cl ZINC000626009712 566374094 /nfs/dbraw/zinc/37/40/94/566374094.db2.gz QRQZRQZZEVYAEO-BBRMVZONSA-N 1 1 392.721 3.263 10 0 GGAEMO COCCOC[C@@H](O)C[N@H+]1CCC[C@H]1c1ccc(Br)cc1Cl ZINC000626009712 566374099 /nfs/dbraw/zinc/37/40/99/566374099.db2.gz QRQZRQZZEVYAEO-BBRMVZONSA-N 1 1 392.721 3.263 10 0 GGAEMO Cc1cc(Br)ccc1[C@@H]1CCC[N@H+]1C[C@H](O)COC[C@@H]1CCCO1 ZINC000626009182 566374952 /nfs/dbraw/zinc/37/49/52/566374952.db2.gz ANDLJYOCQYIGTQ-LNLFQRSKSA-N 1 1 398.341 3.451 10 0 GGAEMO Cc1cc(Br)ccc1[C@@H]1CCC[N@H+]1CCC(=O)N1CCOCC1 ZINC000626009498 566374988 /nfs/dbraw/zinc/37/49/88/566374988.db2.gz KJFNPQODGOSVSG-KRWDZBQOSA-N 1 1 381.314 3.143 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2C)[C@H](C)C1 ZINC000510338849 566376118 /nfs/dbraw/zinc/37/61/18/566376118.db2.gz GBHUXGWZILALPU-UKRRQHHQSA-N 1 1 378.460 3.365 10 0 GGAEMO Cc1cc(NC(=O)[C@@H](C)[N@H+]2C[C@@H]3CCC[C@]3(CO)C2)ccc1Br ZINC000626014274 566376241 /nfs/dbraw/zinc/37/62/41/566376241.db2.gz XNYNZNPARMWLJW-QWQRMKEZSA-N 1 1 381.314 3.179 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2C)[C@H](C)C1 ZINC000510338847 566376377 /nfs/dbraw/zinc/37/63/77/566376377.db2.gz GBHUXGWZILALPU-HIFRSBDPSA-N 1 1 378.460 3.365 10 0 GGAEMO OC[C@]12CCC[C@H]1C[N@H+](Cc1nc(-c3ccc(Br)s3)no1)C2 ZINC000626013620 566376467 /nfs/dbraw/zinc/37/64/67/566376467.db2.gz RPUURMGTVXQXAF-ZUZCIYMTSA-N 1 1 384.299 3.155 10 0 GGAEMO OC[C@]12CCC[C@H]1C[N@@H+](Cc1nc(-c3ccc(Br)s3)no1)C2 ZINC000626013620 566376472 /nfs/dbraw/zinc/37/64/72/566376472.db2.gz RPUURMGTVXQXAF-ZUZCIYMTSA-N 1 1 384.299 3.155 10 0 GGAEMO COC[C@H](C)OC[C@@H](O)C[N@H+]1CCC[C@H]1c1ccc(Br)cc1C ZINC000626010041 566376617 /nfs/dbraw/zinc/37/66/17/566376617.db2.gz CLNQOVOETNTDED-ZVZYQTTQSA-N 1 1 386.330 3.307 10 0 GGAEMO CC[C@H](CNC(=O)c1nscc1Br)[N@H+]1CCc2ccccc2C1 ZINC000649602258 566376828 /nfs/dbraw/zinc/37/68/28/566376828.db2.gz USEKLMLXARBLCJ-CQSZACIVSA-N 1 1 394.338 3.472 10 0 GGAEMO CC[N@@H+](Cc1cc(Br)cc(Br)c1N)[C@@H]1CCOC1 ZINC000463022666 566377082 /nfs/dbraw/zinc/37/70/82/566377082.db2.gz FPOWUNRWQMKEDY-LLVKDONJSA-N 1 1 378.108 3.405 10 0 GGAEMO Cc1cc(NC(=O)C[N@@H+]2C[C@H](c3ccc(Br)cc3)C[C@@H]2C)n(C)n1 ZINC000626039886 566377882 /nfs/dbraw/zinc/37/78/82/566377882.db2.gz RGWMKINTFLPHOD-DZGCQCFKSA-N 1 1 391.313 3.308 10 0 GGAEMO C[C@@H]1C[C@H](c2ccc(Br)cc2)C[N@H+]1C[C@H](O)COC[C@@H]1CCCO1 ZINC000626040176 566378214 /nfs/dbraw/zinc/37/82/14/566378214.db2.gz YPWKJTAQKWUXJO-XIVBQZFQSA-N 1 1 398.341 3.183 10 0 GGAEMO C[C@@H]1C[C@H](c2ccc(Br)cc2)C[N@H+]1Cc1cc(=O)n2nccc2[nH]1 ZINC000626040728 566378518 /nfs/dbraw/zinc/37/85/18/566378518.db2.gz KVLCFIYLSAWGGT-OCCSQVGLSA-N 1 1 387.281 3.163 10 0 GGAEMO C[C@@H]1C[C@@H](c2ccc(Br)cc2)C[N@H+]1CC(=O)NCc1cccnc1 ZINC000626041092 566378634 /nfs/dbraw/zinc/37/86/34/566378634.db2.gz QNEYNGDUROGBCV-RHSMWYFYSA-N 1 1 388.309 3.338 10 0 GGAEMO COC[C@H](C)OC[C@H](O)C[N@H+]1C[C@H](c2ccc(Br)cc2)C[C@@H]1C ZINC000626040690 566378901 /nfs/dbraw/zinc/37/89/01/566378901.db2.gz KIRMZFDXNWQQES-KJGCVMFHSA-N 1 1 386.330 3.039 10 0 GGAEMO Cc1cc(C)c(C[S@@](=O)CC(=O)N2CCC[C@H](C(F)(F)F)C2)c(C)[nH+]1 ZINC000600933425 566379739 /nfs/dbraw/zinc/37/97/39/566379739.db2.gz DJPVSJKOHNJNLF-HWRSSNJWSA-N 1 1 376.444 3.056 10 0 GGAEMO C[C@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2nscc2Br)C1 ZINC000649641001 566380004 /nfs/dbraw/zinc/38/00/04/566380004.db2.gz XHMVHBWXWQAEMS-YPMHNXCESA-N 1 1 380.311 3.471 10 0 GGAEMO C[C@@H]1C[C@H](NC(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)C[N@H+]1C1CC1 ZINC000626042000 566380174 /nfs/dbraw/zinc/38/01/74/566380174.db2.gz OPGGCGCGUOCGMO-DPKAMZSRSA-N 1 1 375.310 3.076 10 0 GGAEMO CNC(=O)C[C@@H]([NH2+]CC(=O)Nc1cccc(Cl)c1Cl)c1ccccc1 ZINC000483401910 566380299 /nfs/dbraw/zinc/38/02/99/566380299.db2.gz FNQRNPZQXHYVEK-OAHLLOKOSA-N 1 1 380.275 3.399 10 0 GGAEMO Cc1cc(C)c(C[S@@](=O)CC(=O)N(CC(C)C)CC(F)(F)F)c(C)[nH+]1 ZINC000600935770 566380550 /nfs/dbraw/zinc/38/05/50/566380550.db2.gz QTVVHJXWHLQBSB-RUZDIDTESA-N 1 1 378.460 3.302 10 0 GGAEMO Cc1cc(C)c(C[S@](=O)CC(=O)N(CC(C)C)CC(F)(F)F)c(C)[nH+]1 ZINC000600935775 566380661 /nfs/dbraw/zinc/38/06/61/566380661.db2.gz QTVVHJXWHLQBSB-VWLOTQADSA-N 1 1 378.460 3.302 10 0 GGAEMO CNC(=O)C[C@@H]([NH2+]CC(=O)Nc1c(Cl)cccc1Cl)c1ccccc1 ZINC000483409512 566380774 /nfs/dbraw/zinc/38/07/74/566380774.db2.gz UEUOOVIQERIESX-OAHLLOKOSA-N 1 1 380.275 3.399 10 0 GGAEMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2nscc2Br)C1 ZINC000649640998 566380747 /nfs/dbraw/zinc/38/07/47/566380747.db2.gz XHMVHBWXWQAEMS-AAEUAGOBSA-N 1 1 380.311 3.471 10 0 GGAEMO Cc1c(Cl)c(C(=O)Nc2ccc(C[NH+](C)C)c(Br)c2)nn1C ZINC000421514732 566381469 /nfs/dbraw/zinc/38/14/69/566381469.db2.gz ZQUWCBCAAURINZ-UHFFFAOYSA-N 1 1 385.693 3.458 10 0 GGAEMO O=C(C1CC[NH+](Cc2nc3ccc(Br)cc3o2)CC1)N1CCCC1 ZINC000463076316 566381664 /nfs/dbraw/zinc/38/16/64/566381664.db2.gz WTELNRXQFZXNEK-UHFFFAOYSA-N 1 1 392.297 3.425 10 0 GGAEMO C[C@@H]1CN(C(=O)C[NH2+]C2(c3ccccc3Br)CCC2)C[C@H](C)O1 ZINC000649645875 566382181 /nfs/dbraw/zinc/38/21/81/566382181.db2.gz LMVHTLGUEKRIJE-OKILXGFUSA-N 1 1 381.314 3.054 10 0 GGAEMO C[C@@H](NC(=O)C1CCCC1)C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000510442894 566382524 /nfs/dbraw/zinc/38/25/24/566382524.db2.gz MHOXPWIFASPFEO-GFCCVEGCSA-N 1 1 396.329 3.144 10 0 GGAEMO COc1cc(C)nc(C[NH2+][C@@H]2CCN(c3cccc(Br)c3)C2=O)c1 ZINC000447062317 566383391 /nfs/dbraw/zinc/38/33/91/566383391.db2.gz YYVSRADMRTUMAC-QGZVFWFLSA-N 1 1 390.281 3.056 10 0 GGAEMO COC(=O)CC[N@@H+](Cc1cccc(Br)c1)Cc1nc(C)ccc1O ZINC000483443022 566384315 /nfs/dbraw/zinc/38/43/15/566384315.db2.gz SUAVCMBDNLNFJP-UHFFFAOYSA-N 1 1 393.281 3.423 10 0 GGAEMO CN(C)S(=O)(=O)c1ccc(C[N@@H+]2CC[C@@](C)(c3cccc(F)c3)C2)s1 ZINC000649662138 566384441 /nfs/dbraw/zinc/38/44/41/566384441.db2.gz WXVBSZAUBRBLNU-GOSISDBHSA-N 1 1 382.526 3.301 10 0 GGAEMO CN(C)S(=O)(=O)c1ccc(C[N@H+]2CC[C@@](C)(c3cccc(F)c3)C2)s1 ZINC000649662138 566384449 /nfs/dbraw/zinc/38/44/49/566384449.db2.gz WXVBSZAUBRBLNU-GOSISDBHSA-N 1 1 382.526 3.301 10 0 GGAEMO CCn1c(C[NH2+]Cc2c[nH]c(C(=O)OC)c2)nc2cc(Br)ccc21 ZINC000483487091 566385459 /nfs/dbraw/zinc/38/54/59/566385459.db2.gz QQYIBKVTSLERFU-UHFFFAOYSA-N 1 1 391.269 3.223 10 0 GGAEMO CCn1c(C[NH2+]Cc2ccc(C(N)=O)cc2)nc2cc(Br)ccc21 ZINC000483486550 566385617 /nfs/dbraw/zinc/38/56/17/566385617.db2.gz PDLZNVPSDHOEES-UHFFFAOYSA-N 1 1 387.281 3.207 10 0 GGAEMO C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@H](C)C1=CC[N@@H+](C)CC1 ZINC000510478193 566385842 /nfs/dbraw/zinc/38/58/42/566385842.db2.gz GCTHFUSRHHUGQM-ZIAGYGMSSA-N 1 1 380.330 3.330 10 0 GGAEMO OCC[N@@H+](Cc1ccc(Br)s1)Cc1ccc(-n2cncn2)cc1 ZINC000483495392 566387438 /nfs/dbraw/zinc/38/74/38/566387438.db2.gz CJWZMAHJXSMKGW-UHFFFAOYSA-N 1 1 393.310 3.086 10 0 GGAEMO C[N@@H+](CCCOc1cccc(I)c1)C[C@@H]1CCCOC1 ZINC000557457234 566388019 /nfs/dbraw/zinc/38/80/19/566388019.db2.gz MBQFVVXJVYINHL-AWEZNQCLSA-N 1 1 389.277 3.419 10 0 GGAEMO Cc1cc(Br)c(F)c(C(=O)N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)c1 ZINC000626138003 566388240 /nfs/dbraw/zinc/38/82/40/566388240.db2.gz FTJWYGDXKLDCJX-CVEARBPZSA-N 1 1 399.304 3.270 10 0 GGAEMO C[C@H](NC(=O)C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1)c1cc(Cl)ccc1Cl ZINC000670925273 566388512 /nfs/dbraw/zinc/38/85/12/566388512.db2.gz NWJZYEZWEUTNCA-SGMGOOAPSA-N 1 1 386.323 3.112 10 0 GGAEMO CNS(=O)(=O)C[C@@H]1CCC[N@@H+](C[C@@H](C)c2ccc(C(F)(F)F)cc2)C1 ZINC000626166593 566389133 /nfs/dbraw/zinc/38/91/33/566389133.db2.gz ARCFCFGMXFPXHV-ZIAGYGMSSA-N 1 1 378.460 3.070 10 0 GGAEMO CN(C(=O)[C@@H]1CCOc2ccc(Br)cc21)[C@H]1CC[N@H+](C2CC2)C1 ZINC000649723350 566389328 /nfs/dbraw/zinc/38/93/28/566389328.db2.gz IJBTXHANJIIMGA-LSDHHAIUSA-N 1 1 379.298 3.010 10 0 GGAEMO OCC[N@H+](Cc1ccc(Br)s1)Cc1ccc2c(c1)OCCO2 ZINC000483511503 566389362 /nfs/dbraw/zinc/38/93/62/566389362.db2.gz IZTGQKYDCSGUFK-UHFFFAOYSA-N 1 1 384.295 3.276 10 0 GGAEMO CNS(=O)(=O)C[C@@H]1CCC[N@@H+](Cc2ccc([C@H](C)C(F)(F)F)cc2)C1 ZINC000626165943 566389347 /nfs/dbraw/zinc/38/93/47/566389347.db2.gz JXHGHYZTKNTKPI-DZGCQCFKSA-N 1 1 378.460 3.114 10 0 GGAEMO OCC[N@@H+](Cc1ccc(Br)s1)Cc1ccc2c(c1)OCCO2 ZINC000483511503 566389365 /nfs/dbraw/zinc/38/93/65/566389365.db2.gz IZTGQKYDCSGUFK-UHFFFAOYSA-N 1 1 384.295 3.276 10 0 GGAEMO Cc1noc([C@H]2OCC[C@H]2[NH2+][C@@H](C)C(=O)Nc2ccc(Cl)c(Cl)c2)n1 ZINC000626144760 566389601 /nfs/dbraw/zinc/38/96/01/566389601.db2.gz RFZMPQZNFLABST-PCTYZZJISA-N 1 1 385.251 3.132 10 0 GGAEMO C[C@H](CC(=O)NCC[NH+]1CCN(c2cccc(Cl)c2)CC1)C(F)(F)F ZINC000626165612 566389983 /nfs/dbraw/zinc/38/99/83/566389983.db2.gz BCCXIXXDDGBFAF-CYBMUJFWSA-N 1 1 377.838 3.167 10 0 GGAEMO CC[C@@H](c1ccc(Br)cc1)[N@H+]1CCC[C@@H](CS(=O)(=O)NC)C1 ZINC000626167821 566392161 /nfs/dbraw/zinc/39/21/61/566392161.db2.gz DEIQRTOVHOREKZ-CJNGLKHVSA-N 1 1 389.359 3.161 10 0 GGAEMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)C[C@H](O)COc1ccc(Br)cc1 ZINC000483645238 566395204 /nfs/dbraw/zinc/39/52/04/566395204.db2.gz GBKCTMKDQSBYGK-KSSFIOAISA-N 1 1 394.309 3.457 10 0 GGAEMO NC(=O)c1c(F)cc(Br)cc1N1CCC[N@H+](C2CCCC2)CC1 ZINC000536707812 566396079 /nfs/dbraw/zinc/39/60/79/566396079.db2.gz YEDNSVSHNKKBOR-UHFFFAOYSA-N 1 1 384.293 3.142 10 0 GGAEMO C[C@H](Cc1cccc(Br)c1)NC(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000601281126 566398554 /nfs/dbraw/zinc/39/85/54/566398554.db2.gz ZKAGXCWFQQVFOH-DYVFJYSZSA-N 1 1 380.330 3.258 10 0 GGAEMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000649849031 566399405 /nfs/dbraw/zinc/39/94/05/566399405.db2.gz KVFHDAPJKCFRQT-FRFSOERESA-N 1 1 393.325 3.258 10 0 GGAEMO O=C(Cn1c[nH+]c2c1CCCC2)N[C@H](CCO)c1ccc(Cl)c(Cl)c1 ZINC000557599807 566400946 /nfs/dbraw/zinc/40/09/46/566400946.db2.gz WKBLQTKISLXUMS-OAHLLOKOSA-N 1 1 382.291 3.309 10 0 GGAEMO COC(=O)[C@@H](CC(C)C)NC(=O)C[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000447322555 566402672 /nfs/dbraw/zinc/40/26/72/566402672.db2.gz FNKWGUISWBSXIR-IAQYHMDHSA-N 1 1 375.296 3.348 10 0 GGAEMO COC(=O)[C@H](CC(C)C)NC(=O)C[NH2+][C@H](C)c1ccc(Cl)cc1Cl ZINC000447322554 566403081 /nfs/dbraw/zinc/40/30/81/566403081.db2.gz FNKWGUISWBSXIR-ABAIWWIYSA-N 1 1 375.296 3.348 10 0 GGAEMO OC[C@]1(c2ccccc2)CC[N@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000463361882 566403882 /nfs/dbraw/zinc/40/38/82/566403882.db2.gz OGZZOFZJPIINBD-IBGZPJMESA-N 1 1 386.293 3.461 10 0 GGAEMO OC[C@]1(c2ccccc2)CC[N@@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000463361882 566403884 /nfs/dbraw/zinc/40/38/84/566403884.db2.gz OGZZOFZJPIINBD-IBGZPJMESA-N 1 1 386.293 3.461 10 0 GGAEMO OC[C@]1(c2ccccc2)CC[N@H+](Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000463361882 566403892 /nfs/dbraw/zinc/40/38/92/566403892.db2.gz OGZZOFZJPIINBD-IBGZPJMESA-N 1 1 386.293 3.461 10 0 GGAEMO OC[C@]1(c2ccccc2)CC[N@@H+](Cc2nc3ccc(Br)cc3[nH]2)C1 ZINC000463361882 566403898 /nfs/dbraw/zinc/40/38/98/566403898.db2.gz OGZZOFZJPIINBD-IBGZPJMESA-N 1 1 386.293 3.461 10 0 GGAEMO C[N@H+]1CCCC12CCN(C(=O)[C@H]1[C@@H]3c4cccc(Br)c4C[C@H]13)CC2 ZINC000626349596 566404351 /nfs/dbraw/zinc/40/43/51/566404351.db2.gz IPFIQEPZUSUNIT-CGTJXYLNSA-N 1 1 389.337 3.422 10 0 GGAEMO COc1c(Br)c(C)sc1C(=O)NCC[N@H+]1CCCC[C@H]1C ZINC000463384944 566405905 /nfs/dbraw/zinc/40/59/05/566405905.db2.gz OTINXFFRUKUJBQ-SNVBAGLBSA-N 1 1 375.332 3.432 10 0 GGAEMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000649941679 566408095 /nfs/dbraw/zinc/40/80/95/566408095.db2.gz HPRCIJAWTLLYDR-RBSFLKMASA-N 1 1 379.298 3.058 10 0 GGAEMO CN(C)S(=O)(=O)c1ccc(C[N@@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)cc1 ZINC000463432048 566410284 /nfs/dbraw/zinc/41/02/84/566410284.db2.gz FGVQYYWLUZMJKH-CVEARBPZSA-N 1 1 378.460 3.490 10 0 GGAEMO C[C@H](NC(=O)CSCc1cc(-c2cccs2)on1)C1=CC[N@@H+](C)CC1 ZINC000510742168 566410406 /nfs/dbraw/zinc/41/04/06/566410406.db2.gz XRIHKTVMRMYWMS-ZDUSSCGKSA-N 1 1 377.535 3.403 10 0 GGAEMO CN(C)S(=O)(=O)c1cccc(C[N@@H+](C)[C@H]2CCCC[C@H]2C(F)(F)F)c1 ZINC000463434224 566410661 /nfs/dbraw/zinc/41/06/61/566410661.db2.gz DMMTWFIFDPMSPU-CVEARBPZSA-N 1 1 378.460 3.490 10 0 GGAEMO O[C@H](COCc1ccccc1)C[N@@H+]1CCc2cc(Br)ccc2C1 ZINC000483977443 566410880 /nfs/dbraw/zinc/41/08/80/566410880.db2.gz JINRPZNTONQDTP-IBGZPJMESA-N 1 1 376.294 3.385 10 0 GGAEMO O[C@H](COCc1ccccc1)C[N@H+]1CCc2cc(Br)ccc2C1 ZINC000483977443 566410887 /nfs/dbraw/zinc/41/08/87/566410887.db2.gz JINRPZNTONQDTP-IBGZPJMESA-N 1 1 376.294 3.385 10 0 GGAEMO C[C@H](CNC(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1)Oc1ccccc1Br ZINC000484009247 566411569 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C[C@@H](C(=O)N(C)Cc1ccc(Br)cc1)[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000671254313 566413037 /nfs/dbraw/zinc/41/30/37/566413037.db2.gz BMSGNNADCWDKIQ-KXBFYZLASA-N 1 1 395.341 3.299 10 0 GGAEMO CCNC(=O)C[C@@H]1CCCC[N@H+]1CC(=O)Nc1ccc(Br)c(C)c1 ZINC000671248939 566413095 /nfs/dbraw/zinc/41/30/95/566413095.db2.gz DQFDFPGTPYRECG-HNNXBMFYSA-N 1 1 396.329 3.077 10 0 GGAEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc(F)ccc1I ZINC000510844280 566416600 /nfs/dbraw/zinc/41/66/00/566416600.db2.gz PWNDPYYGSMFUAW-NSHDSACASA-N 1 1 390.240 3.035 10 0 GGAEMO CO[C@@H](c1ccc(Br)cc1)[C@@H](C)NC(=O)N1CC[NH+](C2CC2)CC1 ZINC000537008671 566418132 /nfs/dbraw/zinc/41/81/32/566418132.db2.gz NFGPRTQIVHOQHM-CXAGYDPISA-N 1 1 396.329 3.015 10 0 GGAEMO CO[C@H](c1ccc(Br)cc1)[C@H](C)NC(=O)N1CC[NH+](C2CC2)CC1 ZINC000537008673 566418204 /nfs/dbraw/zinc/41/82/04/566418204.db2.gz NFGPRTQIVHOQHM-GUYCJALGSA-N 1 1 396.329 3.015 10 0 GGAEMO CSc1ccc(NC(=O)NC2CCC([NH+]3CCNCC3)CC2)cc1Cl ZINC000577268186 566418639 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CC[C@@H](CNC(=O)N[C@@H]1CCC[N@@H+](C)C1)Cc1cccc(Br)c1 ZINC000605961577 566621715 /nfs/dbraw/zinc/62/17/15/566621715.db2.gz RYEGUHNOLUMTDD-RHSMWYFYSA-N 1 1 382.346 3.411 10 0 GGAEMO C[C@H](OC[C@H]1CCCCO1)C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000467065222 566622019 /nfs/dbraw/zinc/62/20/19/566622019.db2.gz YKCQMAULGLJRBA-XJKSGUPXSA-N 1 1 399.329 3.423 10 0 GGAEMO CCOC(=O)C1(C(=O)Nc2ccc(C[NH+](C)C)c(Br)c2)CCC1 ZINC000467073515 566623642 /nfs/dbraw/zinc/62/36/42/566623642.db2.gz HQVDVKSDKJVFDM-UHFFFAOYSA-N 1 1 383.286 3.183 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)[C@H]2CCCc3n[nH]cc32)cc1Br ZINC000467076643 566624431 /nfs/dbraw/zinc/62/44/31/566624431.db2.gz XAGMZCKCFQEKDG-ZDUSSCGKSA-N 1 1 377.286 3.292 10 0 GGAEMO CC[C@@H](Cc1ccccc1Br)C(=O)NC[C@@H]1CCC[N@H+]1CCOC ZINC000467097933 566625920 /nfs/dbraw/zinc/62/59/20/566625920.db2.gz TVDRZCKZKPTQEE-RDJZCZTQSA-N 1 1 397.357 3.245 10 0 GGAEMO O=C(C[NH+]1CCC(c2ncc[nH]2)CC1)NCCc1cccc(Cl)c1Cl ZINC000467129958 566628610 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/nfs/dbraw/zinc/63/78/04/566637804.db2.gz IYMDEQLVOQGYII-UHFFFAOYSA-N 1 1 386.514 3.038 10 0 GGAEMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)N[C@@H](C)Cc1ccc(Br)cc1 ZINC000606645189 566637714 /nfs/dbraw/zinc/63/77/14/566637714.db2.gz XORADGBFYLTKCV-WMLDXEAASA-N 1 1 382.346 3.362 10 0 GGAEMO O[C@@H](C[N@@H+](Cc1cccc(Br)c1)C1CCOCC1)C(F)(F)F ZINC000467296818 566637762 /nfs/dbraw/zinc/63/77/62/566637762.db2.gz AJEGXTKTMPHKPT-AWEZNQCLSA-N 1 1 382.220 3.353 10 0 GGAEMO Cn1ncc(Br)c1C[NH2+]Cc1ccc(OCc2ccccn2)cc1 ZINC000486950390 566638108 /nfs/dbraw/zinc/63/81/08/566638108.db2.gz LGLUZBMMGGHYAX-UHFFFAOYSA-N 1 1 387.281 3.446 10 0 GGAEMO COC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1CCC(=O)Nc1ccc(Br)cc1 ZINC000467296865 566638365 /nfs/dbraw/zinc/63/83/65/566638365.db2.gz BGJAKFDDTOYOBO-NUTKFTJISA-N 1 1 395.297 3.051 10 0 GGAEMO COCC[C@@H]1CCCC[N@@H+](C[C@H](O)COc2ccc(Br)cc2)C1 ZINC000467272319 566638436 /nfs/dbraw/zinc/63/84/36/566638436.db2.gz AZBHDRJTBYSYKZ-RDJZCZTQSA-N 1 1 386.330 3.327 10 0 GGAEMO COc1cccc([C@H](CNCc2c(Br)cnn2C)[NH+]2CCCC2)c1 ZINC000486956323 566638443 /nfs/dbraw/zinc/63/84/43/566638443.db2.gz NEPWMLQBBRDIMP-KRWDZBQOSA-N 1 1 393.329 3.118 10 0 GGAEMO COC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@@H+]1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000467289728 566638535 /nfs/dbraw/zinc/63/85/35/566638535.db2.gz DUPFOZUSZOEPFW-DPYKFYPSSA-N 1 1 388.291 3.007 10 0 GGAEMO COC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000467289728 566638539 /nfs/dbraw/zinc/63/85/39/566638539.db2.gz DUPFOZUSZOEPFW-DPYKFYPSSA-N 1 1 388.291 3.007 10 0 GGAEMO CO[C@@H]1C[N@@H+](C[C@@H](O)COc2ccc(Cl)cc2Br)CC[C@@H]1C ZINC000467294106 566638551 /nfs/dbraw/zinc/63/85/51/566638551.db2.gz TXLFGJBUYWGNAJ-NORZTCDRSA-N 1 1 392.721 3.199 10 0 GGAEMO CN(Cc1ccc(F)cc1Br)C(=O)Cn1c[nH+]c2c1CCCC2 ZINC000579785034 566638839 /nfs/dbraw/zinc/63/88/39/566638839.db2.gz OYGVVBSTNRUJAJ-UHFFFAOYSA-N 1 1 380.261 3.322 10 0 GGAEMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000514057578 566639104 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566766523 /nfs/dbraw/zinc/76/65/23/566766523.db2.gz OBIOTWGZSWEVIX-GFCCVEGCSA-N 1 1 381.270 3.036 10 0 GGAEMO CCOc1c(Br)cc(Cl)cc1NC(=O)[C@H]1C[N@H+](CC)CCO1 ZINC000469171255 566767485 /nfs/dbraw/zinc/76/74/85/566767485.db2.gz SPTWNLFMMNVIPH-CYBMUJFWSA-N 1 1 391.693 3.160 10 0 GGAEMO CCOc1c(Br)cc(Cl)cc1NC(=O)[C@H]1C[N@@H+](CC)CCO1 ZINC000469171255 566767491 /nfs/dbraw/zinc/76/74/91/566767491.db2.gz SPTWNLFMMNVIPH-CYBMUJFWSA-N 1 1 391.693 3.160 10 0 GGAEMO COc1cc(Br)ccc1[C@H](C)NC(=O)N[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000469189264 566768704 /nfs/dbraw/zinc/76/87/04/566768704.db2.gz ZQNVNRARPZVDGN-SGMGOOAPSA-N 1 1 384.318 3.301 10 0 GGAEMO CCS(=O)(=O)NCC[NH2+]C(C)(C)c1nc(-c2ccccc2F)c(C)s1 ZINC000451165877 566769561 /nfs/dbraw/zinc/76/95/61/566769561.db2.gz MOVMNBKWAQQMGX-UHFFFAOYSA-N 1 1 385.530 3.022 10 0 GGAEMO Cc1cc(C)c(CSc2nn3c(nnc(C(C)(C)C)c3=O)s2)c(C)[nH+]1 ZINC000631004873 566770777 /nfs/dbraw/zinc/77/07/77/566770777.db2.gz XGLNFUHCMCJKFQ-UHFFFAOYSA-N 1 1 375.523 3.456 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNS(=O)(=O)c1ccc(OC(F)F)c(Cl)c1 ZINC000516605782 566772469 /nfs/dbraw/zinc/77/24/69/566772469.db2.gz BVJNEXOXPLAZGK-LLVKDONJSA-N 1 1 382.860 3.094 10 0 GGAEMO Cc1nccn1CC[N@H+]1CC[C@H](Cc2cccc(I)c2)C1 ZINC000451189779 566772847 /nfs/dbraw/zinc/77/28/47/566772847.db2.gz KAVLFTXMMXDOJA-MRXNPFEDSA-N 1 1 395.288 3.361 10 0 GGAEMO CC(C)[N@@H+](CC(=O)N1CCOC[C@@H]1C1CC1)Cc1cccc(Br)c1 ZINC000677980581 566773590 /nfs/dbraw/zinc/77/35/90/566773590.db2.gz GEHSTSNYPQYJBX-GOSISDBHSA-N 1 1 395.341 3.297 10 0 GGAEMO Nc1ncccc1C[N@H+]1CC[C@H](Cc2cccc(I)c2)C1 ZINC000451191116 566773998 /nfs/dbraw/zinc/77/39/98/566773998.db2.gz MDAJJOYPWMSGCD-CQSZACIVSA-N 1 1 393.272 3.333 10 0 GGAEMO CC(C)[N@@H+](CC(=O)N1CCOC[C@H]1C1CC1)Cc1ccc(Br)cc1 ZINC000677981250 566774133 /nfs/dbraw/zinc/77/41/33/566774133.db2.gz ZEEVREWQPZHSCH-SFHVURJKSA-N 1 1 395.341 3.297 10 0 GGAEMO CC(C)[N@@H+](CC(=O)N1CCOC[C@@H]1C1CC1)Cc1ccc(Br)cc1 ZINC000677981249 566774258 /nfs/dbraw/zinc/77/42/58/566774258.db2.gz ZEEVREWQPZHSCH-GOSISDBHSA-N 1 1 395.341 3.297 10 0 GGAEMO Ic1cccc(C[C@@H]2CC[N@@H+](CCn3ccnc3)C2)c1 ZINC000451193113 566775280 /nfs/dbraw/zinc/77/52/80/566775280.db2.gz PQCRULQTAYVUAP-HNNXBMFYSA-N 1 1 381.261 3.052 10 0 GGAEMO Cn1ccc(C[N@H+]2CCC[C@H]2c2ccccc2I)cc1=O ZINC000609614085 566775656 /nfs/dbraw/zinc/77/56/56/566775656.db2.gz XQOXBAJBSMSPKW-INIZCTEOSA-N 1 1 394.256 3.327 10 0 GGAEMO Cn1nccc1CC[N@H+]1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000451192268 566775837 /nfs/dbraw/zinc/77/58/37/566775837.db2.gz OEBZCGQPNDOBAD-HNNXBMFYSA-N 1 1 395.288 3.132 10 0 GGAEMO Clc1ccc(-n2cc(CN3CCC[C@H]([C@H]4CC[NH2+]C4)C3)nn2)c(Cl)c1 ZINC000516649890 566775758 /nfs/dbraw/zinc/77/57/58/566775758.db2.gz BCXNWZJTRBCCBK-KBPBESRZSA-N 1 1 380.323 3.396 10 0 GGAEMO Brc1cccc(C2([NH2+]Cc3cn(C[C@H]4CCOC4)nn3)CCC2)c1 ZINC000631060482 566775821 /nfs/dbraw/zinc/77/58/21/566775821.db2.gz YDNUITHPPWFKHA-CQSZACIVSA-N 1 1 391.313 3.246 10 0 GGAEMO COc1cncc(C[NH2+]Cc2cc(OC)c(OC)cc2Br)c1C ZINC000631065056 566775935 /nfs/dbraw/zinc/77/59/35/566775935.db2.gz UMZGKJVALJGAGR-UHFFFAOYSA-N 1 1 381.270 3.468 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CNC(=O)N[C@H](C)c1ccc(Br)cc1OC ZINC000469265232 566776300 /nfs/dbraw/zinc/77/63/00/566776300.db2.gz CPFMDFRUDALWQV-TZMCWYRMSA-N 1 1 384.318 3.302 10 0 GGAEMO C[NH+](C)[C@H](CNC(=O)[C@@H]1CCc2cc(Br)ccc21)c1ccco1 ZINC000581430765 566776440 /nfs/dbraw/zinc/77/64/40/566776440.db2.gz NGMJNDUWBKAWLM-HZPDHXFCSA-N 1 1 377.282 3.491 10 0 GGAEMO O=C(NCc1c[nH+]c2n1CCCC2)N1CCc2c1cccc2Br ZINC000581423188 566777330 /nfs/dbraw/zinc/77/73/30/566777330.db2.gz BHDZBVZWHIFXOQ-UHFFFAOYSA-N 1 1 375.270 3.254 10 0 GGAEMO Cc1nc(NC(=O)NCC[NH+]2CCN(c3cccc(Cl)c3)CC2)cs1 ZINC000678052847 566778305 /nfs/dbraw/zinc/77/83/05/566778305.db2.gz ZZVZQZHEEZEBMK-UHFFFAOYSA-N 1 1 379.917 3.049 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)Nc1cccc(Br)c1Cl ZINC000516744982 566779567 /nfs/dbraw/zinc/77/95/67/566779567.db2.gz MOSQLZILTHXREN-LLVKDONJSA-N 1 1 390.709 3.335 10 0 GGAEMO CC[C@@H]1COCC[N@H+]1CCCOc1cccc(I)c1 ZINC000609673699 566779788 /nfs/dbraw/zinc/77/97/88/566779788.db2.gz YEGPTHUDCLNWNB-CQSZACIVSA-N 1 1 375.250 3.171 10 0 GGAEMO C[N@H+]1CCC[C@@H](CCNC(=O)N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000655143109 566781198 /nfs/dbraw/zinc/78/11/98/566781198.db2.gz AEFKJYTVXQULIH-XJKSGUPXSA-N 1 1 396.329 3.304 10 0 GGAEMO CO[C@H](C(=O)N1CC[NH2+][C@@H](c2ccccc2)C1)c1ccccc1Br ZINC000655139982 566781514 /nfs/dbraw/zinc/78/15/14/566781514.db2.gz ZTVIXGFMNJRIQH-MSOLQXFVSA-N 1 1 389.293 3.310 10 0 GGAEMO O=C(N[C@@H]1CCCC[C@H]1[NH+]1CCOCC1)N1CCc2sc(Cl)cc2C1 ZINC000516764819 566781863 /nfs/dbraw/zinc/78/18/63/566781863.db2.gz NNHWWYNTKOEWIX-HUUCEWRRSA-N 1 1 383.945 3.113 10 0 GGAEMO C[N@H+]1CCC[C@H](CNS(=O)(=O)C[C@H]2CCCC2(F)F)[C@@H]1c1cccs1 ZINC000451246271 566782336 /nfs/dbraw/zinc/78/23/36/566782336.db2.gz VOJGKDFXVBUAOX-IIAWOOMASA-N 1 1 392.537 3.486 10 0 GGAEMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000655143142 566783258 /nfs/dbraw/zinc/78/32/58/566783258.db2.gz NCDAWLHFWPIXNI-HIFRSBDPSA-N 1 1 382.302 3.008 10 0 GGAEMO CCO[C@@H]1C[C@H]([NH2+]Cc2ncc(Br)cc2Cl)[C@@H]1n1cccn1 ZINC000631145609 566785920 /nfs/dbraw/zinc/78/59/20/566785920.db2.gz NNYVCUQLWDUNQK-CFVMTHIKSA-N 1 1 385.693 3.202 10 0 GGAEMO CCS(=O)(=O)c1cc(Cl)cc(C[NH2+]Cc2c3c(nn2C)CCCC3)c1 ZINC000631162470 566787049 /nfs/dbraw/zinc/78/70/49/566787049.db2.gz WWHARQRGFTVOHH-UHFFFAOYSA-N 1 1 381.929 3.036 10 0 GGAEMO COc1cc(Br)c(C[N@@H+]2CCC[C@H](n3ccnc3)C2)c(OC)c1 ZINC000678234277 566788871 /nfs/dbraw/zinc/78/88/71/566788871.db2.gz CNDCFNKHFSVLHY-ZDUSSCGKSA-N 1 1 380.286 3.500 10 0 GGAEMO COc1cc(Br)c(C[N@H+]2CCC[C@H](n3ccnc3)C2)c(OC)c1 ZINC000678234277 566788882 /nfs/dbraw/zinc/78/88/82/566788882.db2.gz CNDCFNKHFSVLHY-ZDUSSCGKSA-N 1 1 380.286 3.500 10 0 GGAEMO COc1cc(Br)c(C[N@@H+]2CCC[C@@H](n3ccnc3)C2)c(OC)c1 ZINC000678234276 566789974 /nfs/dbraw/zinc/78/99/74/566789974.db2.gz CNDCFNKHFSVLHY-CYBMUJFWSA-N 1 1 380.286 3.500 10 0 GGAEMO COc1cc(Br)c(C[N@H+]2CCC[C@@H](n3ccnc3)C2)c(OC)c1 ZINC000678234276 566789981 /nfs/dbraw/zinc/78/99/81/566789981.db2.gz CNDCFNKHFSVLHY-CYBMUJFWSA-N 1 1 380.286 3.500 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)c2ccc(N3CCC3)nc2)cc1Br ZINC000451284578 566790309 /nfs/dbraw/zinc/79/03/09/566790309.db2.gz PPAQYBLNHZAGKU-UHFFFAOYSA-N 1 1 389.297 3.368 10 0 GGAEMO CCc1nc(C[NH2+]CCC(=O)Nc2cc(OC)c(Cl)cc2OC)cs1 ZINC000581603095 566791606 /nfs/dbraw/zinc/79/16/06/566791606.db2.gz KNVCMRAVYSFQOP-UHFFFAOYSA-N 1 1 383.901 3.495 10 0 GGAEMO O[C@@H]1C[C@H]([C@@H]2CCCOC2)[N@H+](Cc2c(F)ccc(Br)c2F)C1 ZINC000451306156 566792580 /nfs/dbraw/zinc/79/25/80/566792580.db2.gz RLWHQYOPLAPUSZ-UEKVPHQBSA-N 1 1 376.241 3.089 10 0 GGAEMO O[C@@H]1C[C@H]([C@@H]2CCCOC2)[N@@H+](Cc2c(F)ccc(Br)c2F)C1 ZINC000451306156 566792583 /nfs/dbraw/zinc/79/25/83/566792583.db2.gz RLWHQYOPLAPUSZ-UEKVPHQBSA-N 1 1 376.241 3.089 10 0 GGAEMO C[C@H](CNC(=O)c1c(F)cncc1Br)[N@@H+](C)Cc1ccccc1 ZINC000631221903 566793116 /nfs/dbraw/zinc/79/31/16/566793116.db2.gz MMKQNVSJRLFGHN-GFCCVEGCSA-N 1 1 380.261 3.234 10 0 GGAEMO CCn1nc2c(cc1=O)C[N@H+]([C@H]1CCCc3ccc(Br)cc31)CC2 ZINC000678313203 566794527 /nfs/dbraw/zinc/79/45/27/566794527.db2.gz RNIZIXDHZFADIK-SFHVURJKSA-N 1 1 388.309 3.461 10 0 GGAEMO CCn1nc2c(cc1=O)C[N@@H+]([C@H]1CCCc3ccc(Br)cc31)CC2 ZINC000678313203 566794532 /nfs/dbraw/zinc/79/45/32/566794532.db2.gz RNIZIXDHZFADIK-SFHVURJKSA-N 1 1 388.309 3.461 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)Cn2cnc3ccccc32)cc1Br ZINC000469489604 566794618 /nfs/dbraw/zinc/79/46/18/566794618.db2.gz IISVNLYTHVGWHD-UHFFFAOYSA-N 1 1 387.281 3.499 10 0 GGAEMO COc1ccc(O)cc1C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000469494866 566794644 /nfs/dbraw/zinc/79/46/44/566794644.db2.gz ZAKHYRRDOTXUGS-UHFFFAOYSA-N 1 1 379.254 3.477 10 0 GGAEMO COC[C@H]1CCC[N@H+]1CCCOc1cccc(I)c1 ZINC000610605112 566848371 /nfs/dbraw/zinc/84/83/71/566848371.db2.gz LAYLJJPIPSTEAF-CQSZACIVSA-N 1 1 375.250 3.171 10 0 GGAEMO O=C(N[C@@H]1CCC[N@H+]2CCCC[C@@H]12)c1[nH]nc2ccc(Br)cc21 ZINC000655349299 566797211 /nfs/dbraw/zinc/79/72/11/566797211.db2.gz FRABAWRHCVWOKJ-CABCVRRESA-N 1 1 377.286 3.072 10 0 GGAEMO CC(C)CN(CC(F)(F)F)C(=O)C[N@H+](C)[C@H](CO)c1ccc(Cl)cc1 ZINC000451325881 566797295 /nfs/dbraw/zinc/79/72/95/566797295.db2.gz BVQGEPRXQIUDFU-OAHLLOKOSA-N 1 1 380.838 3.352 10 0 GGAEMO CC(C)CN(CC(F)(F)F)C(=O)C[N@@H+](C)[C@H](CO)c1ccc(Cl)cc1 ZINC000451325881 566797296 /nfs/dbraw/zinc/79/72/96/566797296.db2.gz BVQGEPRXQIUDFU-OAHLLOKOSA-N 1 1 380.838 3.352 10 0 GGAEMO CC(C)CN(CC(F)(F)F)C(=O)C[N@H+](C)[C@@H](CO)c1ccc(Cl)cc1 ZINC000451325880 566797965 /nfs/dbraw/zinc/79/79/65/566797965.db2.gz BVQGEPRXQIUDFU-HNNXBMFYSA-N 1 1 380.838 3.352 10 0 GGAEMO CC(C)CN(CC(F)(F)F)C(=O)C[N@@H+](C)[C@@H](CO)c1ccc(Cl)cc1 ZINC000451325880 566797970 /nfs/dbraw/zinc/79/79/70/566797970.db2.gz BVQGEPRXQIUDFU-HNNXBMFYSA-N 1 1 380.838 3.352 10 0 GGAEMO C[N@H+](CC(=O)N1CCC[C@H](C(F)(F)F)C1)[C@H](CO)c1ccc(Cl)cc1 ZINC000451326116 566798062 /nfs/dbraw/zinc/79/80/62/566798062.db2.gz CGKXEFRAKAJRRU-DZGCQCFKSA-N 1 1 378.822 3.106 10 0 GGAEMO C[N@@H+](CC(=O)N1CCC[C@H](C(F)(F)F)C1)[C@H](CO)c1ccc(Cl)cc1 ZINC000451326116 566798071 /nfs/dbraw/zinc/79/80/71/566798071.db2.gz CGKXEFRAKAJRRU-DZGCQCFKSA-N 1 1 378.822 3.106 10 0 GGAEMO Cc1nc2ccc(S(=O)(=O)N3CC[N@@H+](C)CC34CCCCC4)cc2s1 ZINC000489582934 566798640 /nfs/dbraw/zinc/79/86/40/566798640.db2.gz WHQDKYCJDZATHJ-UHFFFAOYSA-N 1 1 379.551 3.244 10 0 GGAEMO Cc1nc2ccc(S(=O)(=O)N3CC[N@H+](C)CC34CCCCC4)cc2s1 ZINC000489582934 566798643 /nfs/dbraw/zinc/79/86/43/566798643.db2.gz WHQDKYCJDZATHJ-UHFFFAOYSA-N 1 1 379.551 3.244 10 0 GGAEMO O=C(NC[C@H]1CCC[N@H+]1Cc1ccccc1)c1c(F)cncc1Br ZINC000631314070 566798748 /nfs/dbraw/zinc/79/87/48/566798748.db2.gz WXQRNERTRRTWIW-CQSZACIVSA-N 1 1 392.272 3.378 10 0 GGAEMO CN(CC(=O)Nc1ccccc1Br)C(=O)CC[C@@H]1CCCC[N@H+]1C ZINC000581718029 566800528 /nfs/dbraw/zinc/80/05/28/566800528.db2.gz FFALHFRHPMGMPT-AWEZNQCLSA-N 1 1 396.329 3.111 10 0 GGAEMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)[C@@H]1CCc2cc(Br)ccc21 ZINC000517032231 566801596 /nfs/dbraw/zinc/80/15/96/566801596.db2.gz QQEFGBMWIOIKNL-SJKOYZFVSA-N 1 1 376.298 3.436 10 0 GGAEMO C[N@H+]1CC[C@H](NS(=O)(=O)Cc2c(F)cccc2Cl)[C@@H]1c1ccccc1 ZINC000451351232 566802542 /nfs/dbraw/zinc/80/25/42/566802542.db2.gz INDATWUIHHEXOA-ROUUACIJSA-N 1 1 382.888 3.344 10 0 GGAEMO CC(C)N1CC[C@H](NC(=O)CC(F)(F)C[NH3+])[C@@H]1c1ccc(Cl)c(F)c1 ZINC000517037870 566802806 /nfs/dbraw/zinc/80/28/06/566802806.db2.gz VCFYVRITVQZRCW-HOCLYGCPSA-N 1 1 377.838 3.103 10 0 GGAEMO Brc1ccc(C[N@H+]2CC[C@@H](Nc3ncccn3)C2)c2ncccc12 ZINC000581727268 566802775 /nfs/dbraw/zinc/80/27/75/566802775.db2.gz WFXYEJPTFKNJQJ-CQSZACIVSA-N 1 1 384.281 3.474 10 0 GGAEMO CC(C)N1CC[C@H](NC(=O)CC(F)(F)C[NH3+])[C@H]1c1ccc(Cl)c(F)c1 ZINC000517037869 566803026 /nfs/dbraw/zinc/80/30/26/566803026.db2.gz VCFYVRITVQZRCW-GOEBONIOSA-N 1 1 377.838 3.103 10 0 GGAEMO Cc1csc(-c2ccc(S(=O)(=O)N(C)[C@@H]3CC[N@@H+](C)[C@H](C)C3)cc2)n1 ZINC000655523362 566808005 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O=C(Nc1nncs1)C1CC[NH+](Cc2nc3ccc(F)cc3s2)CC1 ZINC000581911944 566813292 /nfs/dbraw/zinc/81/32/92/566813292.db2.gz QEIVSBDEHXDAAM-UHFFFAOYSA-N 1 1 377.470 3.138 10 0 GGAEMO C[C@H](C(=O)Nc1ccccc1Br)[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451410715 566813706 /nfs/dbraw/zinc/81/37/06/566813706.db2.gz CVGVZPOOHYTLAJ-GFOFROLCSA-N 1 1 381.314 3.402 10 0 GGAEMO C[C@H](C(=O)Nc1ccccc1Br)[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451410715 566813709 /nfs/dbraw/zinc/81/37/09/566813709.db2.gz CVGVZPOOHYTLAJ-GFOFROLCSA-N 1 1 381.314 3.402 10 0 GGAEMO CC(C)OCC[NH+]1CCN(C(=O)[C@@H]2CCc3cc(Br)ccc32)CC1 ZINC000517237525 566814173 /nfs/dbraw/zinc/81/41/73/566814173.db2.gz JWMWEVDEAYPRAD-GOSISDBHSA-N 1 1 395.341 3.048 10 0 GGAEMO C[C@H](C(=O)Nc1ccccc1Br)[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451410713 566814185 /nfs/dbraw/zinc/81/41/85/566814185.db2.gz CVGVZPOOHYTLAJ-BQGCOEIASA-N 1 1 381.314 3.402 10 0 GGAEMO C[C@H](C(=O)Nc1ccccc1Br)[N@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451410713 566814188 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GGAEMO Cc1[nH+]cn(CCCCc2noc(-c3csc(S(C)(=O)=O)c3)n2)c1C ZINC000656038214 566866388 /nfs/dbraw/zinc/86/63/88/566866388.db2.gz UGRPEEDWATZFLW-UHFFFAOYSA-N 1 1 380.495 3.038 10 0 GGAEMO C[N@@H+](C[C@H](O)CNCc1ccc(Br)cc1C(F)(F)F)C1CC1 ZINC000582481832 566866819 /nfs/dbraw/zinc/86/68/19/566866819.db2.gz JCKVFXMKDLHZGX-CYBMUJFWSA-N 1 1 381.236 3.013 10 0 GGAEMO CN(C[C@H](O)C[NH2+]Cc1ccc(Br)cc1C(F)(F)F)C1CC1 ZINC000582481832 566866825 /nfs/dbraw/zinc/86/68/25/566866825.db2.gz JCKVFXMKDLHZGX-CYBMUJFWSA-N 1 1 381.236 3.013 10 0 GGAEMO CN(Cc1ccccc1Br)C(=O)C[N@@H+]1CCC[C@H](OC(F)F)C1 ZINC000679682181 566868138 /nfs/dbraw/zinc/86/81/38/566868138.db2.gz UOTXSTXUSFHQKX-ZDUSSCGKSA-N 1 1 391.256 3.111 10 0 GGAEMO CN(Cc1ccccc1Br)C(=O)C[N@H+]1CCC[C@H](OC(F)F)C1 ZINC000679682181 566868141 /nfs/dbraw/zinc/86/81/41/566868141.db2.gz UOTXSTXUSFHQKX-ZDUSSCGKSA-N 1 1 391.256 3.111 10 0 GGAEMO O=C1C[C@H]([C@H]2CCCC[N@@H+]2CC[S@@](=O)c2cc(Cl)ccc2Cl)CN1 ZINC000490613879 566870214 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C[C@H]1COCC[N@H+]1C1CCN(Cc2nc3cc(Br)ccc3[nH]2)CC1 ZINC000563362547 566878229 /nfs/dbraw/zinc/87/82/29/566878229.db2.gz BOPCXSOOZVZHGH-ZDUSSCGKSA-N 1 1 393.329 3.011 10 0 GGAEMO C[C@H]1COCC[N@@H+]1C1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000563362547 566878233 /nfs/dbraw/zinc/87/82/33/566878233.db2.gz BOPCXSOOZVZHGH-ZDUSSCGKSA-N 1 1 393.329 3.011 10 0 GGAEMO C[C@H]1COCC[N@H+]1C1CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000563362547 566878237 /nfs/dbraw/zinc/87/82/37/566878237.db2.gz BOPCXSOOZVZHGH-ZDUSSCGKSA-N 1 1 393.329 3.011 10 0 GGAEMO COc1ccc(CCC(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)cc1Br ZINC000518364437 566878666 /nfs/dbraw/zinc/87/86/66/566878666.db2.gz AYVROVFXHCLQPS-OAHLLOKOSA-N 1 1 381.314 3.085 10 0 GGAEMO Cc1ccnc([C@H]2CC[N@@H+](C[C@@H](O)COc3ccc(Br)cc3)C2)c1 ZINC000563365901 566879603 /nfs/dbraw/zinc/87/96/03/566879603.db2.gz FMPFARQUZHDUPX-DOTOQJQBSA-N 1 1 391.309 3.382 10 0 GGAEMO COc1ccc(Br)c2[nH]c(C(=O)N(C)[C@@H]3CC[N@H+](C4CC4)C3)cc21 ZINC000518428813 566882730 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CN(Cc1ccccc1Br)C(=O)C[N@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000543483127 566885575 /nfs/dbraw/zinc/88/55/75/566885575.db2.gz IGOADJNFPZBSDI-DOTOQJQBSA-N 1 1 397.357 3.136 10 0 GGAEMO CS(=O)(=O)CC[C@H]1CCCC[N@@H+]1CCOc1ccc(Br)cc1 ZINC000428880332 566885946 /nfs/dbraw/zinc/88/59/46/566885946.db2.gz KBNGMTLMHMIEQJ-OAHLLOKOSA-N 1 1 390.343 3.117 10 0 GGAEMO CS(=O)(=O)CC[C@H]1CCCC[N@H+]1CCOc1ccc(Br)cc1 ZINC000428880332 566885966 /nfs/dbraw/zinc/88/59/66/566885966.db2.gz KBNGMTLMHMIEQJ-OAHLLOKOSA-N 1 1 390.343 3.117 10 0 GGAEMO NC(=O)c1c[nH+]ccc1N1CCN(c2cc(Cl)c(Cl)c(Cl)c2)CC1 ZINC000656224865 566886272 /nfs/dbraw/zinc/88/62/72/566886272.db2.gz AHBRANGFCMYFLS-UHFFFAOYSA-N 1 1 385.682 3.467 10 0 GGAEMO CS(=O)(=O)CC[C@@H]1CCCC[N@@H+]1CCOc1ccc(Br)cc1 ZINC000428880330 566886837 /nfs/dbraw/zinc/88/68/37/566886837.db2.gz KBNGMTLMHMIEQJ-HNNXBMFYSA-N 1 1 390.343 3.117 10 0 GGAEMO CS(=O)(=O)CC[C@@H]1CCCC[N@H+]1CCOc1ccc(Br)cc1 ZINC000428880330 566886840 /nfs/dbraw/zinc/88/68/40/566886840.db2.gz KBNGMTLMHMIEQJ-HNNXBMFYSA-N 1 1 390.343 3.117 10 0 GGAEMO O=C(NCC[NH+]1CCSCC1)N1CCC[C@@H]1c1ccc(Br)cc1 ZINC000491036642 566890126 /nfs/dbraw/zinc/89/01/26/566890126.db2.gz YTPLPUSUIVAHKI-MRXNPFEDSA-N 1 1 398.370 3.344 10 0 GGAEMO Cc1nn(-c2ccccc2Br)cc1C[N@H+]1CCCC[C@@H]1CC(N)=O ZINC000656251098 566890562 /nfs/dbraw/zinc/89/05/62/566890562.db2.gz GVYOXCAMKLUEHS-OAHLLOKOSA-N 1 1 391.313 3.173 10 0 GGAEMO COc1nccnc1C[N@@H+]1CCC[C@H](Nc2cccc(Br)c2)C1 ZINC000582765773 566891453 /nfs/dbraw/zinc/89/14/53/566891453.db2.gz OVMYDLNSPVXCCV-HNNXBMFYSA-N 1 1 377.286 3.324 10 0 GGAEMO COc1nccnc1C[N@H+]1CCC[C@H](Nc2cccc(Br)c2)C1 ZINC000582765773 566891460 /nfs/dbraw/zinc/89/14/60/566891460.db2.gz OVMYDLNSPVXCCV-HNNXBMFYSA-N 1 1 377.286 3.324 10 0 GGAEMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)c2c(F)cncc2Br)CC1 ZINC000632544457 566893193 /nfs/dbraw/zinc/89/31/93/566893193.db2.gz GVKQDQKGFHUIJF-UHFFFAOYSA-N 1 1 384.293 3.391 10 0 GGAEMO COc1cc(S(=O)(=O)N[C@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)ccc1Cl ZINC000563539930 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Cc1cc(I)ccc1NC(=O)C[N@H+]1CC[C@@H](C(F)F)C1 ZINC000611179482 566897065 /nfs/dbraw/zinc/89/70/65/566897065.db2.gz DAAJITNUHVVGAZ-SNVBAGLBSA-N 1 1 394.203 3.125 10 0 GGAEMO C[C@@H](C(=O)Nc1cccc(I)c1)[N@@H+]1CC[C@H](C(F)F)C1 ZINC000611180059 566897129 /nfs/dbraw/zinc/89/71/29/566897129.db2.gz QSVGJMYMYZKQRR-UWVGGRQHSA-N 1 1 394.203 3.205 10 0 GGAEMO C[C@@H](C(=O)Nc1cccc(I)c1)[N@H+]1CC[C@H](C(F)F)C1 ZINC000611180059 566897133 /nfs/dbraw/zinc/89/71/33/566897133.db2.gz QSVGJMYMYZKQRR-UWVGGRQHSA-N 1 1 394.203 3.205 10 0 GGAEMO COc1cc(Br)ccc1C[NH2+]Cc1cnnn1Cc1ccccc1 ZINC000491211726 566897682 /nfs/dbraw/zinc/89/76/82/566897682.db2.gz FFOUZYCUNHQWOV-UHFFFAOYSA-N 1 1 387.281 3.387 10 0 GGAEMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)NCCc2ccccc2Br)C1 ZINC000470719411 566897758 /nfs/dbraw/zinc/89/77/58/566897758.db2.gz GJELCXRFMHARGA-MRXNPFEDSA-N 1 1 394.357 3.365 10 0 GGAEMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)NCc2cc(F)cc(Br)c2)C1 ZINC000470725040 566898970 /nfs/dbraw/zinc/89/89/70/566898970.db2.gz ALZUTHREEADBJL-CQSZACIVSA-N 1 1 398.320 3.462 10 0 GGAEMO COC(=O)c1ccc(C[N@@H+]2CCN(CC(F)(F)F)C[C@@H](C)C2)cc1Cl ZINC000451879082 566899278 /nfs/dbraw/zinc/89/92/78/566899278.db2.gz IYPKJOPKPCOIHD-LBPRGKRZSA-N 1 1 378.822 3.443 10 0 GGAEMO COC(=O)c1ccc(C[N@H+]2CCN(CC(F)(F)F)C[C@@H](C)C2)cc1Cl ZINC000451879082 566899285 /nfs/dbraw/zinc/89/92/85/566899285.db2.gz IYPKJOPKPCOIHD-LBPRGKRZSA-N 1 1 378.822 3.443 10 0 GGAEMO C[C@@H]1CN(CC(F)(F)F)CC[N@@H+](CCC(=O)Nc2cccc(Cl)c2)C1 ZINC000451870047 566899545 /nfs/dbraw/zinc/89/95/45/566899545.db2.gz HMEZCAWTODGNKO-ZDUSSCGKSA-N 1 1 377.838 3.485 10 0 GGAEMO O=C1[C@H]([N@@H+]2CC[C@H]([C@H](O)C(F)(F)F)C2)CCN1c1ccc(Cl)c(Cl)c1 ZINC000451884244 566900196 /nfs/dbraw/zinc/90/01/96/566900196.db2.gz FZYQXNAUFSMMJA-FZZIBODNSA-N 1 1 397.224 3.344 10 0 GGAEMO O=C1[C@H]([N@H+]2CC[C@H]([C@H](O)C(F)(F)F)C2)CCN1c1ccc(Cl)c(Cl)c1 ZINC000451884244 566900199 /nfs/dbraw/zinc/90/01/99/566900199.db2.gz FZYQXNAUFSMMJA-FZZIBODNSA-N 1 1 397.224 3.344 10 0 GGAEMO 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381.314 3.303 10 0 GGAEMO C[C@@H]1[C@H](C(=O)N2CC3(CCOCC3)c3ccc(Br)cc32)CC[N@H+]1C ZINC000633845381 566998218 /nfs/dbraw/zinc/99/82/18/566998218.db2.gz JLNCKPGCFOKSKL-UKRRQHHQSA-N 1 1 393.325 3.184 10 0 GGAEMO Cc1c[nH+]cn1CC(=O)N1CC2(CCOCC2)c2ccc(Br)cc21 ZINC000633844323 566998235 /nfs/dbraw/zinc/99/82/35/566998235.db2.gz BAWKYJLLABLARV-UHFFFAOYSA-N 1 1 390.281 3.049 10 0 GGAEMO CC[C@@H]1Cc2c(Br)cccc2C[N@H+]1C[C@H](O)COC[C@@H]1CCCO1 ZINC000583974089 566998880 /nfs/dbraw/zinc/99/88/80/566998880.db2.gz GYDUTPCNIJUAJX-IKGGRYGDSA-N 1 1 398.341 3.142 10 0 GGAEMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2Cc2cn(-c3ccc(Cl)cc3Cl)nn2)C1 ZINC000583962081 566999885 /nfs/dbraw/zinc/99/98/85/566999885.db2.gz CWNSIQQPYKJOEX-SUMWQHHRSA-N 1 1 380.323 3.490 10 0 GGAEMO COc1cc2c(cc1C[NH2+]Cc1ccc(Br)cc1OC)OCO2 ZINC000494420345 567000041 /nfs/dbraw/zinc/00/00/41/567000041.db2.gz UIGMUECWLDQJQR-UHFFFAOYSA-N 1 1 380.238 3.485 10 0 GGAEMO Cn1ncc(Br)c1C(=O)N[C@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)cc1 ZINC000564705267 567000521 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CC(C)(CNC(=O)N1CC[NH+](C2CC2)CC1)c1ccc(Br)cc1 ZINC000521523131 567063204 /nfs/dbraw/zinc/06/32/04/567063204.db2.gz ORZYGHIAVQAQMV-UHFFFAOYSA-N 1 1 380.330 3.216 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)Cn2cc(C3CC3)cn2)cc1Br ZINC000613841259 567065785 /nfs/dbraw/zinc/06/57/85/567065785.db2.gz JAZKDZWTEGGAHK-UHFFFAOYSA-N 1 1 377.286 3.223 10 0 GGAEMO C[C@H]([NH2+][C@H]1CCc2[nH]cnc2C1)c1ccc(F)c(I)c1 ZINC000453248059 567066497 /nfs/dbraw/zinc/06/64/97/567066497.db2.gz ISDJSWCRGPRECL-ONGXEEELSA-N 1 1 385.224 3.362 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)COc2ccc(CO)cc2)cc1Br ZINC000613841124 567066465 /nfs/dbraw/zinc/06/64/65/567066465.db2.gz CTXTWQAKWNFPNE-UHFFFAOYSA-N 1 1 393.281 3.021 10 0 GGAEMO C[C@H]1CC[N@@H+](CC(=O)N2CCO[C@H](c3cc(F)c(Cl)cc3Cl)C2)C1 ZINC000565439114 567066553 /nfs/dbraw/zinc/06/65/53/567066553.db2.gz CYZNRDJHJVNSIN-ZBEGNZNMSA-N 1 1 375.271 3.374 10 0 GGAEMO O=C(C[NH2+][C@H](CO)c1ccsc1)Nc1c(F)cc(F)cc1Br ZINC000473176367 567067164 /nfs/dbraw/zinc/06/71/64/567067164.db2.gz 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O=C(CCc1cc(Cl)cs1)NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000617700643 567329885 /nfs/dbraw/zinc/32/98/85/567329885.db2.gz IOXCSIOFQDMHGN-QGZVFWFLSA-N 1 1 378.925 3.217 10 0 GGAEMO O=C(NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cc(Br)cs1 ZINC000617700035 567329937 /nfs/dbraw/zinc/32/99/37/567329937.db2.gz ZDIFGGGFILSPBO-OAHLLOKOSA-N 1 1 395.322 3.007 10 0 GGAEMO O=C(NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1)c1cc(Cl)ccc1Cl ZINC000617696371 567330018 /nfs/dbraw/zinc/33/00/18/567330018.db2.gz HVLINMAEQGZEFY-MRXNPFEDSA-N 1 1 379.287 3.490 10 0 GGAEMO C[C@@H](C(=O)NCc1ccc(C[N@H+]2CC[C@H](O)C2)cc1)c1ccc(Cl)s1 ZINC000617700767 567330314 /nfs/dbraw/zinc/33/03/14/567330314.db2.gz LASOWAIBXGEGKN-CJNGLKHVSA-N 1 1 378.925 3.388 10 0 GGAEMO C[C@H](C[N@@H+](C)Cc1ccccc1)NS(=O)(=O)c1ccc2ncsc2c1 ZINC000476515622 567330923 /nfs/dbraw/zinc/33/09/23/567330923.db2.gz PIKGFCXQYNAQME-CQSZACIVSA-N 1 1 375.519 3.095 10 0 GGAEMO O=C(NC1CC[NH+](CCc2cc(Cl)ccc2Cl)CC1)N1CCOCC1 ZINC000660858082 567331650 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C[C@H]1[C@@H](NC(=O)c2ncsc2Br)CC[N@H+]1Cc1ccccc1 ZINC000568550886 567337753 /nfs/dbraw/zinc/33/77/53/567337753.db2.gz MVXVGQMAICUTCE-AAEUAGOBSA-N 1 1 380.311 3.298 10 0 GGAEMO OCC[N@H+](Cc1ccc(-c2cc[nH]n2)o1)Cc1cc(Br)cs1 ZINC000434985289 567338400 /nfs/dbraw/zinc/33/84/00/567338400.db2.gz HRSQJTSSPYEMJB-UHFFFAOYSA-N 1 1 382.283 3.488 10 0 GGAEMO OCC[N@@H+](Cc1ccc(-c2cc[nH]n2)o1)Cc1cc(Br)cs1 ZINC000434985289 567338407 /nfs/dbraw/zinc/33/84/07/567338407.db2.gz HRSQJTSSPYEMJB-UHFFFAOYSA-N 1 1 382.283 3.488 10 0 GGAEMO O=C(CC[N@@H+]1C[C@@H](CO)[C@H](C(F)(F)F)C1)Nc1cc(Cl)ccc1Cl ZINC000640054570 567339706 /nfs/dbraw/zinc/33/97/06/567339706.db2.gz NTOMIPYKPUNNAU-GXSJLCMTSA-N 1 1 385.213 3.425 10 0 GGAEMO Brc1ccccc1CCCN1CC[NH+](CCc2cnccn2)CC1 ZINC000640100375 567341674 /nfs/dbraw/zinc/34/16/74/567341674.db2.gz YBLFYVFUCPLUOC-UHFFFAOYSA-N 1 1 389.341 3.032 10 0 GGAEMO C[N@H+]1CCC[C@@H]1CNC(=O)N1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1 ZINC000592509709 567342232 /nfs/dbraw/zinc/34/22/32/567342232.db2.gz 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CCOc1cc(-c2noc(Cn3c[nH+]cc3C)n2)cc(Br)c1O ZINC000528168869 567399851 /nfs/dbraw/zinc/39/98/51/567399851.db2.gz YAHKZELAOAEZMZ-UHFFFAOYSA-N 1 1 379.214 3.157 10 0 GGAEMO CN(C)C(=O)N(C)[C@H]1CC[N@H+](Cc2oc3ccccc3c2Br)C1 ZINC000662006842 567402503 /nfs/dbraw/zinc/40/25/03/567402503.db2.gz DCHQKYFTQDCTCY-LBPRGKRZSA-N 1 1 380.286 3.383 10 0 GGAEMO CN(C)C(=O)N(C)[C@H]1CC[N@@H+](Cc2oc3ccccc3c2Br)C1 ZINC000662006842 567402511 /nfs/dbraw/zinc/40/25/11/567402511.db2.gz DCHQKYFTQDCTCY-LBPRGKRZSA-N 1 1 380.286 3.383 10 0 GGAEMO CC(C)(C)CC(C)(C)[NH+]1CCN(C(=O)c2csc(S(C)(=O)=O)c2)CC1 ZINC000456692754 567403198 /nfs/dbraw/zinc/40/31/98/567403198.db2.gz MHHKCAIGFXFJLR-UHFFFAOYSA-N 1 1 386.583 3.124 10 0 GGAEMO Cc1cc(Br)c(CNC(=O)c2cc(C[NH+]3CCCC3)on2)s1 ZINC000618645730 567405371 /nfs/dbraw/zinc/40/53/71/567405371.db2.gz MTCQZAXTDWAWPA-UHFFFAOYSA-N 1 1 384.299 3.333 10 0 GGAEMO COC(=O)c1ccc(-c2nc(CSC[C@@H]3C[N@H+](C)CCO3)cs2)cc1 ZINC000569455042 567405689 /nfs/dbraw/zinc/40/56/89/567405689.db2.gz 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379.342 3.327 10 0 GGAEMO CCC[N@@H+](C)CC(C)(C)NCC(=O)Nc1c(F)cc(F)cc1Br ZINC000662176648 567415154 /nfs/dbraw/zinc/41/51/54/567415154.db2.gz ICSAOFCTWYNSAL-UHFFFAOYSA-N 1 1 392.288 3.376 10 0 GGAEMO COc1ccc(Br)cc1[C@@H]1CCC[N@H+]1C[C@@H](O)CC1(O)CCC1 ZINC000528364418 567415629 /nfs/dbraw/zinc/41/56/29/567415629.db2.gz MPHRSYKNEYHZTB-HOCLYGCPSA-N 1 1 384.314 3.261 10 0 GGAEMO Fc1c(Br)ccc(CN2CCC[C@@H]2C[NH+]2CCOCC2)c1F ZINC000528390755 567418361 /nfs/dbraw/zinc/41/83/61/567418361.db2.gz OXSSOQXBBQMXCU-CYBMUJFWSA-N 1 1 375.257 3.024 10 0 GGAEMO C[N@H+]1CCC[C@H]1CNC(=O)Cc1csc(-c2cccc(Br)c2)n1 ZINC000502133756 567421461 /nfs/dbraw/zinc/42/14/61/567421461.db2.gz ZZFVFNLLXRTMSR-HNNXBMFYSA-N 1 1 394.338 3.326 10 0 GGAEMO C[C@H]1C[N@H+](CCC(=O)N2CCc3sccc3C2)C[C@@H](CC(F)(F)F)O1 ZINC000662245373 567421698 /nfs/dbraw/zinc/42/16/98/567421698.db2.gz WCDOERKDKFUEKA-GXTWGEPZSA-N 1 1 376.444 3.065 10 0 GGAEMO C[C@H]1C[N@@H+](CCC(=O)N2CCc3sccc3C2)C[C@@H](CC(F)(F)F)O1 ZINC000662245373 567421703 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CC[N@H+]1CC[C@H](N(C)C(=O)Nc2cnc3c(Br)cccn23)[C@H](C)C1 ZINC000436490627 567428496 /nfs/dbraw/zinc/42/84/96/567428496.db2.gz QLNPUKXMQGSCOJ-OCCSQVGLSA-N 1 1 394.317 3.291 10 0 GGAEMO C[C@@H](CCc1ccc(I)cc1)[NH2+][C@@H]1CCc2[nH]cnc2C1 ZINC000569746751 567428790 /nfs/dbraw/zinc/42/87/90/567428790.db2.gz DKDBHKVSVHGSFN-SWLSCSKDSA-N 1 1 395.288 3.483 10 0 GGAEMO Cc1[nH+]ccn1CCCCNC(=O)Nc1cnc2c(Br)cccn12 ZINC000436500133 567429464 /nfs/dbraw/zinc/42/94/64/567429464.db2.gz USGDXMULPPPHOX-UHFFFAOYSA-N 1 1 391.273 3.204 10 0 GGAEMO C[C@]1(C(F)F)C[N@H+](CCC(=O)Nc2ccc(Br)cc2)CCO1 ZINC000662370506 567429444 /nfs/dbraw/zinc/42/94/44/567429444.db2.gz OVQHUKRZLUUPIF-OAHLLOKOSA-N 1 1 377.229 3.134 10 0 GGAEMO C[C@]1(C(F)F)C[N@@H+](CCC(=O)Nc2ccc(Br)cc2)CCO1 ZINC000662370506 567429453 /nfs/dbraw/zinc/42/94/53/567429453.db2.gz OVQHUKRZLUUPIF-OAHLLOKOSA-N 1 1 377.229 3.134 10 0 GGAEMO COc1ccc(Cl)cc1NC(=O)CC[N@@H+]1C[C@H](C)O[C@](C)(C(F)F)C1 ZINC000662366200 567430150 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C[N@H+]1CC[C@H](NC(=O)c2cc(Br)ccc2O)[C@@H]1c1ccccc1 ZINC000436524313 567430920 /nfs/dbraw/zinc/43/09/20/567430920.db2.gz GOMWKQRISGKBCR-RDJZCZTQSA-N 1 1 375.266 3.330 10 0 GGAEMO O=C(c1csc(I)c1)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000457004703 567431599 /nfs/dbraw/zinc/43/15/99/567431599.db2.gz YGEQAEQFSSDBNK-ZDUSSCGKSA-N 1 1 398.269 3.139 10 0 GGAEMO C[N@H+]1CC[C@@H](NC(=O)c2cc(Br)ccc2O)[C@@H]1c1ccccc1 ZINC000436524314 567431760 /nfs/dbraw/zinc/43/17/60/567431760.db2.gz GOMWKQRISGKBCR-WBVHZDCISA-N 1 1 375.266 3.330 10 0 GGAEMO O=C(COc1ccc(Br)cc1)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000456997353 567431884 /nfs/dbraw/zinc/43/18/84/567431884.db2.gz QTLPRPFESWBQOX-KRWDZBQOSA-N 1 1 375.266 3.001 10 0 GGAEMO C[C@@H]1CCCC[C@H]1OCCNC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000662387177 567432157 /nfs/dbraw/zinc/43/21/57/567432157.db2.gz CBGITUKINBYIPJ-ZYHUDNBSSA-N 1 1 387.343 3.439 10 0 GGAEMO O=C(COc1ccc(Br)cc1F)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000457006306 567432215 /nfs/dbraw/zinc/43/22/15/567432215.db2.gz 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/nfs/dbraw/zinc/43/46/59/567434659.db2.gz NJUDELNKPMNYFK-SFHVURJKSA-N 1 1 395.247 3.356 10 0 GGAEMO NC(=O)[C@@]1(c2ccccc2)CC[N@@H+](Cc2ccc(Br)c(F)c2F)C1 ZINC000528525692 567434665 /nfs/dbraw/zinc/43/46/65/567434665.db2.gz NJUDELNKPMNYFK-SFHVURJKSA-N 1 1 395.247 3.356 10 0 GGAEMO O=[S@@]1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1 ZINC000593688398 567434736 /nfs/dbraw/zinc/43/47/36/567434736.db2.gz PBCFSTFZKLQVCG-GJVZNYBJSA-N 1 1 387.345 3.264 10 0 GGAEMO O=[S@@]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1 ZINC000593688398 567434741 /nfs/dbraw/zinc/43/47/41/567434741.db2.gz PBCFSTFZKLQVCG-GJVZNYBJSA-N 1 1 387.345 3.264 10 0 GGAEMO COc1ccc(Br)c(CC(=O)N2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC000457031073 567434796 /nfs/dbraw/zinc/43/47/96/567434796.db2.gz SJAZIZYPKAFBPC-SFHVURJKSA-N 1 1 389.293 3.173 10 0 GGAEMO Cc1nc2ccc(Br)cn2c1C(=O)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000457033636 567435027 /nfs/dbraw/zinc/43/50/27/567435027.db2.gz VGLWKTRNNHWWSZ-INIZCTEOSA-N 1 1 399.292 3.192 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(Cc3cc(Br)cc4cccnc43)[C@H]2C1 ZINC000550227091 567435740 /nfs/dbraw/zinc/43/57/40/567435740.db2.gz APBIQXBHPJISEJ-ZWKOTPCHSA-N 1 1 390.325 3.292 10 0 GGAEMO C[NH2+][C@@H](C(=O)NCc1nccn1CC(F)(F)F)c1cccc(Cl)c1Cl ZINC000662443080 567436409 /nfs/dbraw/zinc/43/64/09/567436409.db2.gz ZLTQJPNWIWQPOY-CYBMUJFWSA-N 1 1 395.212 3.329 10 0 GGAEMO O=C(NCCCNc1ccccc1)c1sc2c(c1Br)C[NH2+]C2 ZINC000662442224 567436845 /nfs/dbraw/zinc/43/68/45/567436845.db2.gz YSBQKCAGFVWAOE-UHFFFAOYSA-N 1 1 380.311 3.346 10 0 GGAEMO Cc1cccc(S(=O)(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c1Br ZINC000528551588 567437262 /nfs/dbraw/zinc/43/72/62/567437262.db2.gz NWIMURMCARGBCT-CQSZACIVSA-N 1 1 387.343 3.053 10 0 GGAEMO O=S(=O)(NC[C@@H]1CC[N@H+]1C1CCCC1)c1ccc(CC(F)(F)F)cc1 ZINC000528553084 567437540 /nfs/dbraw/zinc/43/75/40/567437540.db2.gz QPGIXCJDXMHEBD-HNNXBMFYSA-N 1 1 376.444 3.087 10 0 GGAEMO CC[C@H]1CCCC[N@H+]1CCNC(=O)c1sc2c(c1Br)CNC2 ZINC000662457924 567437594 /nfs/dbraw/zinc/43/75/94/567437594.db2.gz GAOQJXWNCNWIRK-NSHDSACASA-N 1 1 386.359 3.108 10 0 GGAEMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000457079098 567438044 /nfs/dbraw/zinc/43/80/44/567438044.db2.gz BFZCVNOJJIRHHP-NSHDSACASA-N 1 1 375.257 3.211 10 0 GGAEMO C[C@@H](O)CN(Cc1ccccc1)C(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000662471285 567439665 /nfs/dbraw/zinc/43/96/65/567439665.db2.gz ADSMYHJOYIGQKR-LLVKDONJSA-N 1 1 395.322 3.137 10 0 GGAEMO CN(Cc1nc2c(s1)CCCC2)C(=O)[C@@H]([NH3+])c1ccccc1Br ZINC000662488868 567440806 /nfs/dbraw/zinc/44/08/06/567440806.db2.gz YYSUJCDHSPGOQY-INIZCTEOSA-N 1 1 394.338 3.443 10 0 GGAEMO CC(C)[C@@H]1CN(C(=O)c2sc3c(c2Br)C[NH2+]C3)CCS1 ZINC000662484397 567441187 /nfs/dbraw/zinc/44/11/87/567441187.db2.gz JKBJCXMVPUXHRG-NSHDSACASA-N 1 1 375.357 3.327 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCO[C@H](c2ccsc2)C1 ZINC000662498358 567441306 /nfs/dbraw/zinc/44/13/06/567441306.db2.gz GMJZUJKKOYRRCF-NSHDSACASA-N 1 1 399.335 3.389 10 0 GGAEMO Cc1nn(C)cc1[C@H]1CCCN1C(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000662499390 567441337 /nfs/dbraw/zinc/44/13/37/567441337.db2.gz ADEYWSPUNVIBQX-GFCCVEGCSA-N 1 1 395.326 3.133 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCC[C@@H]1C1CCOCC1 ZINC000662512025 567442557 /nfs/dbraw/zinc/44/25/57/567442557.db2.gz FXRKDSMCNLFZSW-GFCCVEGCSA-N 1 1 385.327 3.145 10 0 GGAEMO C[NH2+][C@@H](C(=O)NCc1cn(C)nc1C(F)(F)F)c1cccc(Cl)c1Cl ZINC000662506687 567443022 /nfs/dbraw/zinc/44/30/22/567443022.db2.gz CYDGGYSOVMYPQZ-GFCCVEGCSA-N 1 1 395.212 3.323 10 0 GGAEMO O=C(NCc1nc(C2CC2)cs1)c1sc2c(c1Br)C[NH2+]C2 ZINC000662503057 567443344 /nfs/dbraw/zinc/44/33/44/567443344.db2.gz GQWNNBFLCMXSTC-UHFFFAOYSA-N 1 1 384.324 3.378 10 0 GGAEMO O=C(c1sc2ncccc2c1Cl)N1CC[NH+](CC2CCOCC2)CC1 ZINC000528612368 567443435 /nfs/dbraw/zinc/44/34/35/567443435.db2.gz KNOMDULIVJXOPT-UHFFFAOYSA-N 1 1 379.913 3.134 10 0 GGAEMO OC[C@H]1CCC2(CCOCC2)C[N@H+]1CCOc1cccc(Br)c1 ZINC000528641860 567444242 /nfs/dbraw/zinc/44/42/42/567444242.db2.gz VZYPVZLTYBOBNU-MRXNPFEDSA-N 1 1 384.314 3.081 10 0 GGAEMO COc1ccc(Br)cc1C[N@H+]1CC2(CCOCC2)CC[C@@H]1CO ZINC000528642446 567444600 /nfs/dbraw/zinc/44/46/00/567444600.db2.gz YEMNHYNCVSTUES-MRXNPFEDSA-N 1 1 384.314 3.211 10 0 GGAEMO O=C(Nc1ccc(Br)cc1F)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000569939954 567444902 /nfs/dbraw/zinc/44/49/02/567444902.db2.gz DENONUKYUXGFTH-HNNXBMFYSA-N 1 1 379.233 3.162 10 0 GGAEMO OC[C@@H]1CCC2(CCOCC2)C[N@H+]1CCOc1cccc(Br)c1 ZINC000528641859 567445098 /nfs/dbraw/zinc/44/50/98/567445098.db2.gz VZYPVZLTYBOBNU-INIZCTEOSA-N 1 1 384.314 3.081 10 0 GGAEMO C[C@@H]1CC[N@@H+](CC(=O)NC2CCN(Cc3cc(Cl)cc(Cl)c3)CC2)C1 ZINC000569939016 567445201 /nfs/dbraw/zinc/44/52/01/567445201.db2.gz GZRXVULWXIOPNG-CQSZACIVSA-N 1 1 384.351 3.416 10 0 GGAEMO COc1cnccc1[C@@H](C)NC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000662531245 567446258 /nfs/dbraw/zinc/44/62/58/567446258.db2.gz HXOPSWBZDTZAHK-MRVPVSSYSA-N 1 1 382.283 3.008 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCC([C@H]2CCCO2)CC1 ZINC000662532121 567446353 /nfs/dbraw/zinc/44/63/53/567446353.db2.gz NZPHVPYIFRJRFD-GFCCVEGCSA-N 1 1 385.327 3.145 10 0 GGAEMO Cc1[nH]nc(C(F)F)c1NC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000662543542 567447791 /nfs/dbraw/zinc/44/77/91/567447791.db2.gz VUWKCJWQWMMFJE-UHFFFAOYSA-N 1 1 377.214 3.335 10 0 GGAEMO C[N@@H+](CCCCNC(=O)c1cc(=O)[nH]c2ccc(Br)cc21)C1CC1 ZINC000457198747 567448482 /nfs/dbraw/zinc/44/84/82/567448482.db2.gz KJAOFCNYXGBXTL-UHFFFAOYSA-N 1 1 392.297 3.307 10 0 GGAEMO [NH3+][C@H](C(=O)N[C@@H](C[C@H]1CCCO1)C(F)(F)F)c1ccccc1Br ZINC000662585922 567451476 /nfs/dbraw/zinc/45/14/76/567451476.db2.gz MDAAZBVSWYPFEB-ICCXJUOJSA-N 1 1 395.219 3.065 10 0 GGAEMO CC1([NH+]2CCOCC2)CCN(CCOc2cccc(Br)c2)CC1 ZINC000528729696 567451524 /nfs/dbraw/zinc/45/15/24/567451524.db2.gz ISGKOPFUQSZQTN-UHFFFAOYSA-N 1 1 383.330 3.015 10 0 GGAEMO COc1ccc(Br)c(C[NH+]2CCC(C)(N3CCOCC3)CC2)c1 ZINC000528726797 567451559 /nfs/dbraw/zinc/45/15/59/567451559.db2.gz LVFSPYRXYVUSNY-UHFFFAOYSA-N 1 1 383.330 3.144 10 0 GGAEMO CC1(N2CCOCC2)CC[NH+](CCOc2ccccc2Br)CC1 ZINC000528727813 567451593 /nfs/dbraw/zinc/45/15/93/567451593.db2.gz UYWUJBBFTGOWRZ-UHFFFAOYSA-N 1 1 383.330 3.015 10 0 GGAEMO C[C@]12CC[N@@H+]([C@@H]3CC(=O)N(c4ccc(Br)cc4)C3=O)C[C@H]1C2(F)F ZINC000570024476 567452034 /nfs/dbraw/zinc/45/20/34/567452034.db2.gz OJRYJCFGSAKCRG-IOASZLSFSA-N 1 1 399.235 3.058 10 0 GGAEMO C[C@]12CC[N@H+]([C@@H]3CC(=O)N(c4ccc(Br)cc4)C3=O)C[C@H]1C2(F)F ZINC000570024476 567452042 /nfs/dbraw/zinc/45/20/42/567452042.db2.gz OJRYJCFGSAKCRG-IOASZLSFSA-N 1 1 399.235 3.058 10 0 GGAEMO C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1[NH2+]Cc1nc(Cc2cccc(Br)c2)no1 ZINC000528754184 567453218 /nfs/dbraw/zinc/45/32/18/567453218.db2.gz IAULSLXXILTDCY-DRAKQNMHSA-N 1 1 380.286 3.324 10 0 GGAEMO C[N@H+]1CCCC[C@@H]1C(=O)NCc1ccc(I)cc1Cl ZINC000619458442 567454460 /nfs/dbraw/zinc/45/44/60/567454460.db2.gz KILFHHVCIWHGQP-CYBMUJFWSA-N 1 1 392.668 3.045 10 0 GGAEMO [NH3+][C@@H](C(=O)NC[C@@H]1C[C@H](c2ccccc2)CO1)c1ccccc1Br ZINC000662663380 567455519 /nfs/dbraw/zinc/45/55/19/567455519.db2.gz DYAKCIJBPUDWOU-RLFYNMQTSA-N 1 1 389.293 3.138 10 0 GGAEMO O=c1ccc([C@@H]2CCC[N@@H+]2C[C@H](O)COc2ccc(Cl)cc2Cl)n[nH]1 ZINC000528787628 567456378 /nfs/dbraw/zinc/45/63/78/567456378.db2.gz BULGSLHFZZEIFZ-WFASDCNBSA-N 1 1 384.263 3.066 10 0 GGAEMO O=c1ccc([C@@H]2CCC[N@@H+]2C[C@@H](O)COc2cc(Cl)ccc2Cl)n[nH]1 ZINC000528792736 567456961 /nfs/dbraw/zinc/45/69/61/567456961.db2.gz VJGOLDJPXPLNIB-DOMZBBRYSA-N 1 1 384.263 3.066 10 0 GGAEMO O=c1ccc([C@@H]2CCC[N@@H+]2C[C@H](O)COc2c(Cl)cccc2Cl)n[nH]1 ZINC000528794420 567457254 /nfs/dbraw/zinc/45/72/54/567457254.db2.gz ZERSZGUURAGJJN-NHYWBVRUSA-N 1 1 384.263 3.066 10 0 GGAEMO O=C(CC[N@H+]1CCC[C@H]1c1ccc(=O)[nH]n1)Nc1cccc(Br)c1 ZINC000528797113 567458541 /nfs/dbraw/zinc/45/85/41/567458541.db2.gz VEHZYDXWIVQVNP-HNNXBMFYSA-N 1 1 391.269 3.110 10 0 GGAEMO C[NH2+][C@H](C(=O)N1CCC[C@H](C(=O)NC(C)C)C1)c1cccc(Cl)c1Cl ZINC000662733713 567459488 /nfs/dbraw/zinc/45/94/88/567459488.db2.gz KGZUGVROWDLQDW-LRDDRELGSA-N 1 1 386.323 3.017 10 0 GGAEMO CC(C)C[N@H+]1CC[C@@H](CNC(=O)c2ccc(Br)c(F)c2F)C1 ZINC000528813406 567460032 /nfs/dbraw/zinc/46/00/32/567460032.db2.gz JEXVTICRLHBDNG-NSHDSACASA-N 1 1 375.257 3.435 10 0 GGAEMO CC1(C)CN(C(=O)c2sc3c(c2Br)C[NH2+]C3)[C@H]1[C@H]1CCCO1 ZINC000662757793 567461214 /nfs/dbraw/zinc/46/12/14/567461214.db2.gz IXIISWQSJBIPPA-YGRLFVJLSA-N 1 1 385.327 3.143 10 0 GGAEMO Cn1ccnc1[C@H]1N(C(=O)c2sc3c(c2Br)C[NH2+]C3)CC1(C)C ZINC000662756211 567461323 /nfs/dbraw/zinc/46/13/23/567461323.db2.gz IFTULNSGSHSDBB-CYBMUJFWSA-N 1 1 395.326 3.071 10 0 GGAEMO Cc1c2cc(C(=O)N3CC[NH2+]C[C@@H]3c3cccnc3)[nH]c2ccc1Br ZINC000662772199 567461360 /nfs/dbraw/zinc/46/13/60/567461360.db2.gz GJTFKKQEYMZZSO-GOSISDBHSA-N 1 1 399.292 3.421 10 0 GGAEMO CCC[N@@H+](C)C[C@H]1CCN(C(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000502971276 567461972 /nfs/dbraw/zinc/46/19/72/567461972.db2.gz KZGDWXSOOSWPPL-GFCCVEGCSA-N 1 1 389.284 3.460 10 0 GGAEMO O=S(=O)(C1CC[NH+](CCc2cc(Cl)ccc2Cl)CC1)N1CCCC1 ZINC000502958170 567462095 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ZINC000595956452 567595882 /nfs/dbraw/zinc/59/58/82/567595882.db2.gz QSMGTGCWKIRPHH-DTWKUNHWSA-N 1 1 390.290 3.074 10 0 GGAEMO CC[C@H](C)CN(CC)C(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595964898 567596295 /nfs/dbraw/zinc/59/62/95/567596295.db2.gz NOJHXNCYTDTKRU-VIFPVBQESA-N 1 1 392.306 3.464 10 0 GGAEMO C[N@H+]1CCC[C@@]2(CCN(C(=O)Nc3cnc4c(Br)cccn34)C2)C1 ZINC000645009522 567599573 /nfs/dbraw/zinc/59/95/73/567599573.db2.gz XDHPVLYPRIUAKD-QGZVFWFLSA-N 1 1 392.301 3.046 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)C(=O)NCCc2cccc(Br)c2)[C@@H](C)C1 ZINC000459146834 567600788 /nfs/dbraw/zinc/60/07/88/567600788.db2.gz JFUWRBUAHLLQDH-YOEHRIQHSA-N 1 1 382.346 3.363 10 0 GGAEMO O=C(N[C@@H]1CCCc2sc(Cl)cc21)N1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC000664949997 567601117 /nfs/dbraw/zinc/60/11/17/567601117.db2.gz PKJWSJSRBVRQRD-UKRRQHHQSA-N 1 1 383.945 3.020 10 0 GGAEMO Cc1c(Cl)cccc1S(=O)(=O)NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000480437256 567604678 /nfs/dbraw/zinc/60/46/78/567604678.db2.gz ORCFIQDCUCDKRF-KRWDZBQOSA-N 1 1 378.925 3.449 10 0 GGAEMO CC[N@@H+](C)[C@@H](C(=O)N[C@H](C)c1ncc(Br)cn1)c1ccccc1 ZINC000552729712 567605847 /nfs/dbraw/zinc/60/58/47/567605847.db2.gz FBRRDNXNHNYXJS-IUODEOHRSA-N 1 1 377.286 3.109 10 0 GGAEMO CC[N@@H+](C)[C@@H](C(=O)N[C@@H](C)c1ncc(Br)cn1)c1ccccc1 ZINC000552729713 567606016 /nfs/dbraw/zinc/60/60/16/567606016.db2.gz FBRRDNXNHNYXJS-SWLSCSKDSA-N 1 1 377.286 3.109 10 0 GGAEMO O=S1(=O)CCCN1CC[N@@H+]1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000439950501 567608877 /nfs/dbraw/zinc/60/88/77/567608877.db2.gz OIUFUGTYMUMORQ-MRXNPFEDSA-N 1 1 376.444 3.268 10 0 GGAEMO O=C(Nc1ccccc1Br)N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000665121980 567609157 /nfs/dbraw/zinc/60/91/57/567609157.db2.gz RCCCWPZZRJXWTM-HZPDHXFCSA-N 1 1 394.313 3.214 10 0 GGAEMO C[N@H+]1CCC[C@@H](CCNC(=O)N2CCc3cccc(Br)c3C2)C1 ZINC000459251704 567609362 /nfs/dbraw/zinc/60/93/62/567609362.db2.gz GHNPBWOTFOIRGL-AWEZNQCLSA-N 1 1 380.330 3.249 10 0 GGAEMO O=C([C@H]1CCC[N@@H+](Cc2nc3cc(Br)ccc3[nH]2)C1)N1CCCC1 ZINC000480535910 567611198 /nfs/dbraw/zinc/61/11/98/567611198.db2.gz AKBWROXDUBPYTM-ZDUSSCGKSA-N 1 1 391.313 3.160 10 0 GGAEMO O=C([C@H]1CCC[N@H+](Cc2nc3cc(Br)ccc3[nH]2)C1)N1CCCC1 ZINC000480535910 567611206 /nfs/dbraw/zinc/61/12/06/567611206.db2.gz AKBWROXDUBPYTM-ZDUSSCGKSA-N 1 1 391.313 3.160 10 0 GGAEMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2n[nH]c3ccc(Br)cc32)C1 ZINC000530580485 567611453 /nfs/dbraw/zinc/61/14/53/567611453.db2.gz BWHJXOAVMKXADE-CYBMUJFWSA-N 1 1 391.313 3.129 10 0 GGAEMO C[N@H+](CC1CC1)C[C@H]1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)C1 ZINC000530580485 567611461 /nfs/dbraw/zinc/61/14/61/567611461.db2.gz BWHJXOAVMKXADE-CYBMUJFWSA-N 1 1 391.313 3.129 10 0 GGAEMO C[N@@H+](CC1CC1)C[C@H]1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)C1 ZINC000530580485 567611470 /nfs/dbraw/zinc/61/14/70/567611470.db2.gz BWHJXOAVMKXADE-CYBMUJFWSA-N 1 1 391.313 3.129 10 0 GGAEMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2n[nH]c3ccc(Br)cc32)C1 ZINC000530580486 567612195 /nfs/dbraw/zinc/61/21/95/567612195.db2.gz BWHJXOAVMKXADE-ZDUSSCGKSA-N 1 1 391.313 3.129 10 0 GGAEMO C[N@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)C1 ZINC000530580486 567612200 /nfs/dbraw/zinc/61/22/00/567612200.db2.gz BWHJXOAVMKXADE-ZDUSSCGKSA-N 1 1 391.313 3.129 10 0 GGAEMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)c2[nH]nc3ccc(Br)cc32)C1 ZINC000530580486 567612205 /nfs/dbraw/zinc/61/22/05/567612205.db2.gz BWHJXOAVMKXADE-ZDUSSCGKSA-N 1 1 391.313 3.129 10 0 GGAEMO CCCN(C(=O)N[C@@H]1CCOc2ccc(Br)cc21)[C@@H]1CC[N@@H+](C)C1 ZINC000645204624 567613526 /nfs/dbraw/zinc/61/35/26/567613526.db2.gz LSZCZCGGJDHELF-GDBMZVCRSA-N 1 1 396.329 3.398 10 0 GGAEMO Cn1cc(C[C@@H]2CC[N@@H+](C[C@@H](O)COc3c(Cl)cccc3Cl)C2)cn1 ZINC000530627036 567614450 /nfs/dbraw/zinc/61/44/50/567614450.db2.gz BEFLVNBKEXJJRB-DZGCQCFKSA-N 1 1 384.307 3.031 10 0 GGAEMO Cc1cc(Br)ccc1NC(=O)N[C@@H](C)C[N@H+](C)CCC[NH+](C)C ZINC000665217996 567614614 /nfs/dbraw/zinc/61/46/14/567614614.db2.gz DEBTXLIBAWPTRN-AWEZNQCLSA-N 1 1 385.350 3.151 10 0 GGAEMO Cc1cc(Br)ccc1NC(=O)N[C@@H](C)C[N@@H+](C)CCC[NH+](C)C ZINC000665217996 567614619 /nfs/dbraw/zinc/61/46/19/567614619.db2.gz DEBTXLIBAWPTRN-AWEZNQCLSA-N 1 1 385.350 3.151 10 0 GGAEMO Cc1ncsc1CCNC(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)cc1 ZINC000572111453 567614821 /nfs/dbraw/zinc/61/48/21/567614821.db2.gz CVSJYCLWEDQGFT-NVXWUHKLSA-N 1 1 378.929 3.392 10 0 GGAEMO Cc1ncsc1CCNC(=O)N[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)cc1 ZINC000572111453 567614823 /nfs/dbraw/zinc/61/48/23/567614823.db2.gz CVSJYCLWEDQGFT-NVXWUHKLSA-N 1 1 378.929 3.392 10 0 GGAEMO Cn1cc(C[C@H]2CC[N@@H+](C[C@@H](O)COc3c(Cl)cccc3Cl)C2)cn1 ZINC000530627038 567615070 /nfs/dbraw/zinc/61/50/70/567615070.db2.gz BEFLVNBKEXJJRB-UKRRQHHQSA-N 1 1 384.307 3.031 10 0 GGAEMO CNC(=O)CCOC1CC[NH+](Cc2cc(Cl)cc(Br)c2)CC1 ZINC000459348204 567617459 /nfs/dbraw/zinc/61/74/59/567617459.db2.gz SFXDGNXYTXBWMN-UHFFFAOYSA-N 1 1 389.721 3.220 10 0 GGAEMO COc1ccc(CCC(=O)NC[C@@H](c2ccco2)[NH+](C)C)c(Br)c1 ZINC000665316095 567618674 /nfs/dbraw/zinc/61/86/74/567618674.db2.gz UUZZYXCRIDOWJQ-INIZCTEOSA-N 1 1 395.297 3.402 10 0 GGAEMO COCC[NH+]1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)CC1 ZINC000506262756 567618727 /nfs/dbraw/zinc/61/87/27/567618727.db2.gz QQHARTHFCDXDTK-UHFFFAOYSA-N 1 1 396.354 3.337 10 0 GGAEMO CC(C)(C)OC(=O)[C@@H]1CC[N@H+](Cc2cc3c(cc2Br)OCO3)C1 ZINC000530687211 567619253 /nfs/dbraw/zinc/61/92/53/567619253.db2.gz IXFTYWKXJQZJTD-LLVKDONJSA-N 1 1 384.270 3.341 10 0 GGAEMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](Cc2cc3c(cc2Br)OCO3)C1 ZINC000530687211 567619258 /nfs/dbraw/zinc/61/92/58/567619258.db2.gz IXFTYWKXJQZJTD-LLVKDONJSA-N 1 1 384.270 3.341 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)N[C@H](CCO)c1ccccc1Br ZINC000665361099 567622197 /nfs/dbraw/zinc/62/21/97/567622197.db2.gz IVXXDUHUJHQPSD-CZUORRHYSA-N 1 1 398.345 3.045 10 0 GGAEMO C[NH+](C)[C@H](CNC(=O)C1(C(F)(F)F)CCOCC1)c1ccccc1Cl ZINC000665387139 567622271 /nfs/dbraw/zinc/62/22/71/567622271.db2.gz ICGKENFEVTYCPN-CQSZACIVSA-N 1 1 378.822 3.418 10 0 GGAEMO CC(C)[C@H](NCC(F)(F)F)C(=O)NC[C@@H](c1ccccc1Cl)[NH+](C)C ZINC000665387305 567623013 /nfs/dbraw/zinc/62/30/13/567623013.db2.gz LNZPAFRPEYMWEX-GJZGRUSLSA-N 1 1 379.854 3.235 10 0 GGAEMO CCCN(C(=O)NCc1ccc(Br)cc1OC)[C@@H]1CC[N@@H+](C)C1 ZINC000645453980 567626628 /nfs/dbraw/zinc/62/66/28/567626628.db2.gz ZCBNWASLGDRBIT-OAHLLOKOSA-N 1 1 384.318 3.083 10 0 GGAEMO CSc1cccc(CSCC(=O)NC[C@H]2C[N@@H+](CC(C)C)CCO2)c1 ZINC000596379206 567627546 /nfs/dbraw/zinc/62/75/46/567627546.db2.gz BOLLSLQALNAEIS-KRWDZBQOSA-N 1 1 382.595 3.115 10 0 GGAEMO CCOc1cc(C[N@@H+](C[C@H](C)C(=O)OC)C2CC2)cc(Br)c1O ZINC000459481035 567629033 /nfs/dbraw/zinc/62/90/33/567629033.db2.gz MIWHGDUWIBTWAD-NSHDSACASA-N 1 1 386.286 3.327 10 0 GGAEMO CC(C)C[N@H+]1CCO[C@@H](CNC(=O)CSC[C@H]2CCCCC2(F)F)C1 ZINC000596397844 567629083 /nfs/dbraw/zinc/62/90/83/567629083.db2.gz YDMOQNAIFVKDHU-CVEARBPZSA-N 1 1 378.529 3.018 10 0 GGAEMO CCOc1cc(C[N@@H+](C[C@@H](C)C(=O)OC)C2CC2)cc(Br)c1O ZINC000459481034 567629092 /nfs/dbraw/zinc/62/90/92/567629092.db2.gz MIWHGDUWIBTWAD-LLVKDONJSA-N 1 1 386.286 3.327 10 0 GGAEMO Cn1cncc1CC[N@@H+](CCc1ccc(Cl)cc1)C[C@H](O)C(F)(F)F ZINC000459521071 567632266 /nfs/dbraw/zinc/63/22/66/567632266.db2.gz HCRGRSWBBMBJLO-INIZCTEOSA-N 1 1 375.822 3.084 10 0 GGAEMO CC(C)OC[C@H](O)C[N@H+]1CCC[C@H]1c1ccccc1I ZINC000506597381 567632555 /nfs/dbraw/zinc/63/25/55/567632555.db2.gz VJABKZMFHKHQMT-CJNGLKHVSA-N 1 1 389.277 3.214 10 0 GGAEMO CC(C)OC[C@H](O)C[N@H+]1CCC[C@@H]1c1ccccc1I ZINC000506597383 567632679 /nfs/dbraw/zinc/63/26/79/567632679.db2.gz VJABKZMFHKHQMT-CZUORRHYSA-N 1 1 389.277 3.214 10 0 GGAEMO Cc1c(C(=O)NC2CC[NH+](Cc3cccc(Br)c3)CC2)ccn1C ZINC000665675830 567633993 /nfs/dbraw/zinc/63/39/93/567633993.db2.gz HDUABOAIWLGHBL-UHFFFAOYSA-N 1 1 390.325 3.490 10 0 GGAEMO C[N@H+]1CCC[C@H](N2CCN(c3nccc4cc(Br)ccc43)CC2)C1 ZINC000665701480 567636402 /nfs/dbraw/zinc/63/64/02/567636402.db2.gz VBCQNFMNEDNQCS-KRWDZBQOSA-N 1 1 389.341 3.214 10 0 GGAEMO CCC[C@H]1CN(Cc2nc3cc(Br)ccc3[nH]2)CC[N@H+]1CCOC ZINC000480856291 567636351 /nfs/dbraw/zinc/63/63/51/567636351.db2.gz JYLOFFOUQSMSKS-HNNXBMFYSA-N 1 1 395.345 3.258 10 0 GGAEMO CCC[C@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CC[N@@H+]1CCOC ZINC000480856291 567636354 /nfs/dbraw/zinc/63/63/54/567636354.db2.gz JYLOFFOUQSMSKS-HNNXBMFYSA-N 1 1 395.345 3.258 10 0 GGAEMO CCC[C@H]1CN(Cc2nc3ccc(Br)cc3[nH]2)CC[N@H+]1CCOC ZINC000480856291 567636360 /nfs/dbraw/zinc/63/63/60/567636360.db2.gz JYLOFFOUQSMSKS-HNNXBMFYSA-N 1 1 395.345 3.258 10 0 GGAEMO CN([C@H]1CC[N@@H+](C2CC2)C1)S(=O)(=O)c1cc(Cl)ccc1OC(F)(F)F ZINC000645529484 567638386 /nfs/dbraw/zinc/63/83/86/567638386.db2.gz HWWRSQAEIRSLBZ-LBPRGKRZSA-N 1 1 398.834 3.096 10 0 GGAEMO CN([C@H]1CC[N@H+](C2CC2)C1)S(=O)(=O)c1cc(Cl)ccc1OC(F)(F)F ZINC000645529484 567638393 /nfs/dbraw/zinc/63/83/93/567638393.db2.gz HWWRSQAEIRSLBZ-LBPRGKRZSA-N 1 1 398.834 3.096 10 0 GGAEMO CCOc1cc(CN2CC[N@H+](C3CC3)C[C@H](C)C2)cc(Br)c1O ZINC000459573131 567639432 /nfs/dbraw/zinc/63/94/32/567639432.db2.gz RPWTWPZQEOSCCI-CYBMUJFWSA-N 1 1 383.330 3.470 10 0 GGAEMO CCN(C(=O)Nc1cc(OC)c(OC)cc1Br)[C@@H]1CC[N@@H+](C)C1 ZINC000665836125 567640047 /nfs/dbraw/zinc/64/00/47/567640047.db2.gz KZLGLGVSDTZYTP-LLVKDONJSA-N 1 1 386.290 3.024 10 0 GGAEMO C[N@H+]1CCCC[C@@H]1CCC(=O)N1CCOc2cc(Br)ccc2C1 ZINC000622182709 567642919 /nfs/dbraw/zinc/64/29/19/567642919.db2.gz RTKGZQSYQVBZDN-MRXNPFEDSA-N 1 1 381.314 3.435 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CCC(=O)N1CCOc2cc(Br)ccc2C1 ZINC000622182708 567643047 /nfs/dbraw/zinc/64/30/47/567643047.db2.gz RTKGZQSYQVBZDN-INIZCTEOSA-N 1 1 381.314 3.435 10 0 GGAEMO CCN(C(=O)Nc1ccc(I)cc1C)[C@H]1CC[N@@H+](C)C1 ZINC000596632139 567645303 /nfs/dbraw/zinc/64/53/03/567645303.db2.gz YJFQQDRODKMOCJ-ZDUSSCGKSA-N 1 1 387.265 3.158 10 0 GGAEMO C[C@H](N)[C@@H](Cc1ccccc1)[NH2+]CCc1ccc(I)cc1 ZINC000596655908 567646678 /nfs/dbraw/zinc/64/66/78/567646678.db2.gz ZNPBFHMXGPZRQW-KBXCAEBGSA-N 1 1 394.300 3.382 10 0 GGAEMO Cc1c(Br)cccc1NC(=O)N[C@@H](C)C[N@H+](C)CCC[NH+](C)C ZINC000665947608 567647506 /nfs/dbraw/zinc/64/75/06/567647506.db2.gz SSHPIAINGJNPCR-ZDUSSCGKSA-N 1 1 385.350 3.151 10 0 GGAEMO O=C(NC1CC[NH+](Cc2cccc(Br)c2)CC1)N1CC(C2CC2)C1 ZINC000665953401 567647581 /nfs/dbraw/zinc/64/75/81/567647581.db2.gz XNVGGKXMTKKTCJ-UHFFFAOYSA-N 1 1 392.341 3.465 10 0 GGAEMO CNC(=O)CCOC1CC[NH+](Cc2cc(Br)ccc2Cl)CC1 ZINC000531214583 567647888 /nfs/dbraw/zinc/64/78/88/567647888.db2.gz ALGTZNUBOJLMOM-UHFFFAOYSA-N 1 1 389.721 3.220 10 0 GGAEMO Cc1c(Br)c2ccccc2n1CC(=O)N[C@@H]1C[C@@H](C)[N@H+](C2CC2)C1 ZINC000440910617 567648047 /nfs/dbraw/zinc/64/80/47/567648047.db2.gz DCYRXSSXGBEHGH-TZMCWYRMSA-N 1 1 390.325 3.454 10 0 GGAEMO C[C@H]1C[C@@H](NC(=O)CSCc2cc(-c3cccs3)on2)C[N@H+]1C1CC1 ZINC000440925709 567649584 /nfs/dbraw/zinc/64/95/84/567649584.db2.gz NDLFAGDYELJAET-QWHCGFSZSA-N 1 1 377.535 3.378 10 0 GGAEMO CCN(C(=O)Nc1cc(Br)ccc1-n1cccn1)[C@H]1CC[N@@H+](C)C1 ZINC000666038813 567650106 /nfs/dbraw/zinc/65/01/06/567650106.db2.gz ZIOPYMBDUMAENY-AWEZNQCLSA-N 1 1 392.301 3.193 10 0 GGAEMO CCOCC[NH+]1CCN(c2ccc(Br)c(C(F)(F)F)n2)CC1 ZINC000553408195 567650932 /nfs/dbraw/zinc/65/09/32/567650932.db2.gz RYRJDGLEMCJZFW-UHFFFAOYSA-N 1 1 382.224 3.021 10 0 GGAEMO C[C@@H]1CC[N@@H+](CC(=O)NCc2cc(Br)ccc2OC(F)F)C1 ZINC000553418614 567652215 /nfs/dbraw/zinc/65/22/15/567652215.db2.gz WYIWAKAZJJNQHA-SNVBAGLBSA-N 1 1 377.229 3.009 10 0 GGAEMO C[C@H]1CC[N@@H+](CC(=O)NCc2cc(Br)ccc2OC(F)F)C1 ZINC000553418613 567652559 /nfs/dbraw/zinc/65/25/59/567652559.db2.gz WYIWAKAZJJNQHA-JTQLQIEISA-N 1 1 377.229 3.009 10 0 GGAEMO C[C@H](Cn1cc(Br)ccc1=O)[NH2+]Cc1c(F)c(F)cc(F)c1F ZINC000666107690 567654409 /nfs/dbraw/zinc/65/44/09/567654409.db2.gz WVFQMQTZDGXDDC-MRVPVSSYSA-N 1 1 393.178 3.346 10 0 GGAEMO O=C(CC(F)(F)F)NC[C@H]1CCC[N@H+](Cc2ccc(Br)o2)C1 ZINC000572646780 567655175 /nfs/dbraw/zinc/65/51/75/567655175.db2.gz KNFJGEVUTYTOHM-SNVBAGLBSA-N 1 1 383.208 3.323 10 0 GGAEMO O=C(CC(F)(F)F)NC[C@H]1CCC[N@@H+](Cc2ccc(Br)o2)C1 ZINC000572646780 567655179 /nfs/dbraw/zinc/65/51/79/567655179.db2.gz KNFJGEVUTYTOHM-SNVBAGLBSA-N 1 1 383.208 3.323 10 0 GGAEMO CCN(C(=O)Nc1ccc(Br)c(C(=O)OC)c1)[C@H]1CC[N@@H+](CC)C1 ZINC000596820410 567655481 /nfs/dbraw/zinc/65/54/81/567655481.db2.gz ONTTXVODZNJLJA-ZDUSSCGKSA-N 1 1 398.301 3.184 10 0 GGAEMO C[C@H](Cn1cc(Br)ccc1=O)[NH2+][C@@H]1COc2cc(F)cc(F)c21 ZINC000666127332 567655820 /nfs/dbraw/zinc/65/58/20/567655820.db2.gz MSUJUMYTINTVIZ-NOZJJQNGSA-N 1 1 385.208 3.001 10 0 GGAEMO O=C(NC[C@H]1CCC[N@H+]1Cc1ccccc1)c1ncsc1Br ZINC000553465255 567656404 /nfs/dbraw/zinc/65/64/04/567656404.db2.gz CNMXZMHAAGMLQB-CYBMUJFWSA-N 1 1 380.311 3.300 10 0 GGAEMO CN1CC[C@H]([NH2+][C@@H]2CCN(c3ccccc3Br)C2)[C@H]2CCC[C@@H]21 ZINC000572655317 567656599 /nfs/dbraw/zinc/65/65/99/567656599.db2.gz YVNYTDMDTXBQCY-LMSBXDPUSA-N 1 1 378.358 3.490 10 0 GGAEMO Cc1cc(NC(=O)C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)ccc1Br ZINC000441201930 567657141 /nfs/dbraw/zinc/65/71/41/567657141.db2.gz QRGYMJBADXLQIY-HUUCEWRRSA-N 1 1 381.314 3.445 10 0 GGAEMO Cc1c(Br)cncc1C(=O)NC[C@H](C)[N@H+]1CCc2ccccc2C1 ZINC000666168062 567657342 /nfs/dbraw/zinc/65/73/42/567657342.db2.gz MDLICVQVSIRSHC-ZDUSSCGKSA-N 1 1 388.309 3.329 10 0 GGAEMO CC(C)[NH+]1CCN(C(=O)c2c(F)c(F)c(Br)c(F)c2F)CC1 ZINC000666143299 567657840 /nfs/dbraw/zinc/65/78/40/567657840.db2.gz JUZLVKAONAQKFP-UHFFFAOYSA-N 1 1 383.183 3.172 10 0 GGAEMO C[C@H](NC(=O)C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1)c1ccc(Br)cc1 ZINC000441201931 567657749 /nfs/dbraw/zinc/65/77/49/567657749.db2.gz HBZAEFXLNCRKKH-USXIJHARSA-N 1 1 395.341 3.375 10 0 GGAEMO NC(=O)C1([NH2+]Cc2c(F)cccc2Br)C2CC3CC(C2)CC1C3 ZINC000459768348 567658543 /nfs/dbraw/zinc/65/85/43/567658543.db2.gz GCZNWTCFXITHNK-UHFFFAOYSA-N 1 1 381.289 3.358 10 0 GGAEMO Brc1cc2c(cc1C[N@H+]1CCC[C@H]([C@H]3CCOC3)C1)OCCO2 ZINC000441278637 567659158 /nfs/dbraw/zinc/65/91/58/567659158.db2.gz ATOOJKFQBLPDFH-KBPBESRZSA-N 1 1 382.298 3.469 10 0 GGAEMO CN(Cc1ccccc1Br)C(=O)C[N@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000441290100 567659241 /nfs/dbraw/zinc/65/92/41/567659241.db2.gz UCCQASQMPGKCRS-RDJZCZTQSA-N 1 1 395.341 3.156 10 0 GGAEMO CN(Cc1ccccc1Br)C(=O)C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000441290096 567659265 /nfs/dbraw/zinc/65/92/65/567659265.db2.gz UCCQASQMPGKCRS-DOTOQJQBSA-N 1 1 395.341 3.156 10 0 GGAEMO Brc1cc2c(cc1C[N@H+]1CCC[C@@H]([C@@H]3CCOC3)C1)OCCO2 ZINC000441278643 567659282 /nfs/dbraw/zinc/65/92/82/567659282.db2.gz ATOOJKFQBLPDFH-ZIAGYGMSSA-N 1 1 382.298 3.469 10 0 GGAEMO O[C@@H](COc1ccc(Cl)cc1Br)C[N@H+]1C[C@@H]2C[C@H]1CS2 ZINC000459794544 567659585 /nfs/dbraw/zinc/65/95/85/567659585.db2.gz MZJXOIVNOGBPNG-TUAOUCFPSA-N 1 1 378.719 3.032 10 0 GGAEMO CCN(C(=O)Nc1ccc(Br)c(C(=O)OC)c1C)[C@@H]1CC[N@@H+](C)C1 ZINC000596872812 567659816 /nfs/dbraw/zinc/65/98/16/567659816.db2.gz ZZMDUALSFBBEFE-GFCCVEGCSA-N 1 1 398.301 3.102 10 0 GGAEMO CCN(C(=O)Nc1cccc(C(=O)OC)c1Br)[C@@H]1CC[N@@H+](CC)C1 ZINC000596872320 567660272 /nfs/dbraw/zinc/66/02/72/567660272.db2.gz GFEDZTFFUOJOST-GFCCVEGCSA-N 1 1 398.301 3.184 10 0 GGAEMO Brc1ccc(-c2nnc(C[N@H+]3CCC[C@@H]([C@H]4CCOC4)C3)o2)o1 ZINC000441290974 567660684 /nfs/dbraw/zinc/66/06/84/567660684.db2.gz VNKANIMMKQVLKY-NEPJUHHUSA-N 1 1 382.258 3.341 10 0 GGAEMO O=C(C[N@@H+]1CCC[C@H]([C@@H]2CCOC2)C1)Nc1ccc(Br)cc1F ZINC000441294828 567660803 /nfs/dbraw/zinc/66/08/03/567660803.db2.gz IISXLLGEJHLMHV-QWHCGFSZSA-N 1 1 385.277 3.275 10 0 GGAEMO O=C(C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1)Nc1ccc(Br)cc1F ZINC000441294828 567660804 /nfs/dbraw/zinc/66/08/04/567660804.db2.gz IISXLLGEJHLMHV-QWHCGFSZSA-N 1 1 385.277 3.275 10 0 GGAEMO Brc1ccc(-c2nnc(C[N@H+]3CCC[C@H]([C@H]4CCOC4)C3)o2)o1 ZINC000441290977 567661079 /nfs/dbraw/zinc/66/10/79/567661079.db2.gz VNKANIMMKQVLKY-RYUDHWBXSA-N 1 1 382.258 3.341 10 0 GGAEMO Brc1ccc(-c2nnc(C[N@H+]3CCC[C@H]([C@@H]4CCOC4)C3)o2)o1 ZINC000441290976 567661437 /nfs/dbraw/zinc/66/14/37/567661437.db2.gz VNKANIMMKQVLKY-NWDGAFQWSA-N 1 1 382.258 3.341 10 0 GGAEMO C[C@H]1CC[N@@H+](CC(=O)Nc2cccc(Oc3ncc(Br)cn3)c2)C1 ZINC000572779288 567664461 /nfs/dbraw/zinc/66/44/61/567664461.db2.gz GVMJZXMDIOQUMA-LBPRGKRZSA-N 1 1 391.269 3.312 10 0 GGAEMO Brc1cccc(Cc2noc(C[N@@H+]3CCC[C@H]4COCC[C@@H]43)n2)c1 ZINC000531547987 567664939 /nfs/dbraw/zinc/66/49/39/567664939.db2.gz QIFGTZAXTXSPNO-HOCLYGCPSA-N 1 1 392.297 3.424 10 0 GGAEMO Brc1cccc(Cc2noc(C[N@H+]3CCC[C@H]4COCC[C@@H]43)n2)c1 ZINC000531547987 567664944 /nfs/dbraw/zinc/66/49/44/567664944.db2.gz QIFGTZAXTXSPNO-HOCLYGCPSA-N 1 1 392.297 3.424 10 0 GGAEMO Brc1cccc(Cc2noc(C[N@@H+]3CCC[C@H]4COCC[C@H]43)n2)c1 ZINC000531547985 567665051 /nfs/dbraw/zinc/66/50/51/567665051.db2.gz QIFGTZAXTXSPNO-GOEBONIOSA-N 1 1 392.297 3.424 10 0 GGAEMO Brc1cccc(Cc2noc(C[N@H+]3CCC[C@H]4COCC[C@H]43)n2)c1 ZINC000531547985 567665052 /nfs/dbraw/zinc/66/50/52/567665052.db2.gz QIFGTZAXTXSPNO-GOEBONIOSA-N 1 1 392.297 3.424 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CNC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000507218788 567666671 /nfs/dbraw/zinc/66/66/71/567666671.db2.gz MIFKGTZOBVNZHU-SWLSCSKDSA-N 1 1 382.302 3.056 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)c1cc2cc(Br)cc(C)c2o1 ZINC000507259480 567670693 /nfs/dbraw/zinc/67/06/93/567670693.db2.gz AVFDDVJESBBBOA-HNNXBMFYSA-N 1 1 395.297 3.344 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc2cc(Br)cc(C)c2o1 ZINC000507259481 567671028 /nfs/dbraw/zinc/67/10/28/567671028.db2.gz AVFDDVJESBBBOA-OAHLLOKOSA-N 1 1 395.297 3.344 10 0 GGAEMO C[N@H+]1CC[C@@H]2CN(C(=O)N[C@@H]3CSCc4ccc(Br)cc43)C[C@@H]21 ZINC000666400191 567672510 /nfs/dbraw/zinc/67/25/10/567672510.db2.gz DXPBZXVBMIHRMT-LYRGGWFBSA-N 1 1 396.354 3.083 10 0 GGAEMO CN(CC[N@@H+](C)C1CC1)C(=O)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000666401854 567674602 /nfs/dbraw/zinc/67/46/02/567674602.db2.gz QRDFFUDFBWMLMS-MRXNPFEDSA-N 1 1 398.370 3.473 10 0 GGAEMO O=C(NCC[N@@H+]1CC=CCC1)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000666402392 567675110 /nfs/dbraw/zinc/67/51/10/567675110.db2.gz XZZYQSJVIOGZJS-MRXNPFEDSA-N 1 1 396.354 3.298 10 0 GGAEMO Cc1c(Br)c2ccccc2n1CC(=O)N[C@@H]1CC[N@H+]2CCCC[C@H]12 ZINC000481379417 567675261 /nfs/dbraw/zinc/67/52/61/567675261.db2.gz BSSPXQLXBNENIW-NVXWUHKLSA-N 1 1 390.325 3.455 10 0 GGAEMO CCC[N@@H+](C)[C@H](CNC(=O)NCC[C@H](C)[S@@](C)=O)c1ccc(Cl)cc1 ZINC000553677715 567675543 /nfs/dbraw/zinc/67/55/43/567675543.db2.gz RVZNRMKSQAEDTK-PHDITVQNSA-N 1 1 387.977 3.179 10 0 GGAEMO C[N@H+]1CCCN(C(=O)N[C@H]2CSCc3ccc(Br)cc32)CC1 ZINC000666405413 567676736 /nfs/dbraw/zinc/67/67/36/567676736.db2.gz XVSUBPFLHKHKHJ-HNNXBMFYSA-N 1 1 384.343 3.084 10 0 GGAEMO CC1=CC[N@@H+](CCNC(=O)NC2(c3cccc(Br)c3)CC2)CC1 ZINC000460212493 567679150 /nfs/dbraw/zinc/67/91/50/567679150.db2.gz BFVQDGWYBDCTDX-UHFFFAOYSA-N 1 1 378.314 3.389 10 0 GGAEMO Brc1cccc2c1C[N@H+](CCc1nnnn1-c1ccccc1)CC2 ZINC000531802298 567680264 /nfs/dbraw/zinc/68/02/64/567680264.db2.gz MMJNTGSKHINTIE-UHFFFAOYSA-N 1 1 384.281 3.026 10 0 GGAEMO Brc1cccc2c1C[N@@H+](CCc1nnnn1-c1ccccc1)CC2 ZINC000531802298 567680269 /nfs/dbraw/zinc/68/02/69/567680269.db2.gz MMJNTGSKHINTIE-UHFFFAOYSA-N 1 1 384.281 3.026 10 0 GGAEMO C[C@H](C(=O)Nc1ccc(I)cc1)[N@@H+]1CCS[C@H](C)C1 ZINC000507732214 567702077 /nfs/dbraw/zinc/70/20/77/567702077.db2.gz MJHFMOXJSTVTAQ-GHMZBOCLSA-N 1 1 390.290 3.056 10 0 GGAEMO C[C@H](C(=O)Nc1ccc(I)cc1)[N@H+]1CCS[C@H](C)C1 ZINC000507732214 567702082 /nfs/dbraw/zinc/70/20/82/567702082.db2.gz MJHFMOXJSTVTAQ-GHMZBOCLSA-N 1 1 390.290 3.056 10 0 GGAEMO COC(=O)[C@@H]1C[C@@H]1[C@H](C)[NH2+][C@@H](C)c1nc(-c2ccc(Br)cc2)no1 ZINC000597113648 567682933 /nfs/dbraw/zinc/68/29/33/567682933.db2.gz QJBRGNSKQFMPMS-DUBDDPSESA-N 1 1 394.269 3.347 10 0 GGAEMO COC(=O)[C@@H]1C[C@@H]1[C@H](C)[NH2+][C@H](C)c1nc(-c2ccc(Br)cc2)no1 ZINC000597113650 567683623 /nfs/dbraw/zinc/68/36/23/567683623.db2.gz QJBRGNSKQFMPMS-GZZJDILISA-N 1 1 394.269 3.347 10 0 GGAEMO CSc1ncc(Cl)c(C(=O)N(C)[C@H]2CC[N@@H+](Cc3ccccc3)C2)n1 ZINC000531893753 567685652 /nfs/dbraw/zinc/68/56/52/567685652.db2.gz QYWYAAUNQKNJCC-AWEZNQCLSA-N 1 1 376.913 3.198 10 0 GGAEMO COc1ccc(Br)cc1C1([NH2+]CC(=O)N(C)CC(F)(F)F)CC1 ZINC000645974317 567685879 /nfs/dbraw/zinc/68/58/79/567685879.db2.gz PEUKNVHMVDYRKA-UHFFFAOYSA-N 1 1 395.219 3.057 10 0 GGAEMO COc1ccc(Br)cc1C1([NH2+]CC(=O)NCc2ccccc2)CC1 ZINC000645974485 567686481 /nfs/dbraw/zinc/68/64/81/567686481.db2.gz CCJGBSKSYBELHS-UHFFFAOYSA-N 1 1 389.293 3.353 10 0 GGAEMO C[C@@]12COC[C@]1(C)C[N@@H+](Cc1ccc(F)cc1I)C2 ZINC000597196072 567688658 /nfs/dbraw/zinc/68/86/58/567688658.db2.gz QJFJMNQAWJGDJN-GASCZTMLSA-N 1 1 375.225 3.289 10 0 GGAEMO C[C@@]12COC[C@]1(C)C[N@H+](Cc1ccc(F)cc1I)C2 ZINC000597196072 567688662 /nfs/dbraw/zinc/68/86/62/567688662.db2.gz QJFJMNQAWJGDJN-GASCZTMLSA-N 1 1 375.225 3.289 10 0 GGAEMO O=C(N[C@H]1CC[N@H+]2CCC[C@@H]2C1)c1c(F)c(F)c(Br)c(F)c1F ZINC000666607899 567689264 /nfs/dbraw/zinc/68/92/64/567689264.db2.gz DUTIVGPBGWBAKK-JGVFFNPUSA-N 1 1 395.194 3.362 10 0 GGAEMO COC(=O)c1ccc(C[NH2+][C@@H](c2ccccc2)[C@H](C)O)c(Br)c1 ZINC000597249613 567691330 /nfs/dbraw/zinc/69/13/30/567691330.db2.gz WCZBCBUNAGEVRR-YVEFUNNKSA-N 1 1 378.266 3.447 10 0 GGAEMO Cc1cc(Br)c(CNC(=O)N2CC[N@H+](C3CC3)C[C@@H](C)C2)s1 ZINC000666638958 567691390 /nfs/dbraw/zinc/69/13/90/567691390.db2.gz 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1 378.476 3.278 10 0 GGAEMO CCOC(=O)C1=C(C[NH+]2CCCCC2)N(C)C(=O)N[C@@H]1c1cccc(Cl)c1 ZINC000035991036 570505131 /nfs/dbraw/zinc/50/51/31/570505131.db2.gz RWOLHLBUAYREBH-GOSISDBHSA-N 1 1 391.899 3.339 10 0 GGAEMO CCOC(=O)C1=C(C[NH+]2CCCCC2)N(C)C(=O)N[C@H]1c1cccc(Cl)c1 ZINC000035991037 570505152 /nfs/dbraw/zinc/50/51/52/570505152.db2.gz RWOLHLBUAYREBH-SFHVURJKSA-N 1 1 391.899 3.339 10 0 GGAEMO CCOC(=O)C1=C(C[NH+]2CCC(C)CC2)N(C)C(=O)N[C@H]1c1cccc(F)c1 ZINC000035991661 570505791 /nfs/dbraw/zinc/50/57/91/570505791.db2.gz WTMYURBEIOFCQD-IBGZPJMESA-N 1 1 389.471 3.071 10 0 GGAEMO COC[C@H](C)[NH+]1CCN([C@@H](C)C(=O)Nc2ccccc2-c2ccccc2)CC1 ZINC000072308081 570525923 /nfs/dbraw/zinc/52/59/23/570525923.db2.gz KDNYCJJWUGIDAJ-OALUTQOASA-N 1 1 381.520 3.333 10 0 GGAEMO CC[C@@H](C)N(C(=O)C[N@@H+](C)C1CCN(Cc2cc(C)no2)CC1)[C@H](C)CC ZINC000072308329 570527753 /nfs/dbraw/zinc/52/77/53/570527753.db2.gz QPWXLSYJABARCA-QZTJIDSGSA-N 1 1 378.561 3.305 10 0 GGAEMO 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386.467 3.218 10 0 GGAEMO C[N@@H+](CCc1ccccn1)[C@@H]1CCCN(Cc2cccn2-c2ccccn2)C1 ZINC000022851645 570556026 /nfs/dbraw/zinc/55/60/26/570556026.db2.gz WAOHAZVAXBAMRL-OAQYLSRUSA-N 1 1 375.520 3.406 10 0 GGAEMO CC(C)n1cc(CN2CC[N@@H+](C3CCN(C)CC3)[C@@H](CCO)C2)c2ccccc21 ZINC000022914633 570571803 /nfs/dbraw/zinc/57/18/03/570571803.db2.gz PVTDDJFDXCTTHR-QFIPXVFZSA-N 1 1 398.595 3.185 10 0 GGAEMO CC(C)n1cc(CN2CC[N@H+](C3CCN(C)CC3)[C@@H](CCO)C2)c2ccccc21 ZINC000022914633 570571807 /nfs/dbraw/zinc/57/18/07/570571807.db2.gz PVTDDJFDXCTTHR-QFIPXVFZSA-N 1 1 398.595 3.185 10 0 GGAEMO C[NH+]1CCN(C(=O)c2ccc3c(c2)NC(=O)/C(=C\c2cccc(Cl)c2)O3)CC1 ZINC000032983961 570572578 /nfs/dbraw/zinc/57/25/78/570572578.db2.gz UXILUIIINVOXEE-XDHOZWIPSA-N 1 1 397.862 3.100 10 0 GGAEMO CN(C)c1ccc2c(c1)CN(C(=O)[C@@H]1CCC[N@@H+]1Cc1ccc(F)cc1)CC2 ZINC000225427854 570573286 /nfs/dbraw/zinc/57/32/86/570573286.db2.gz KGAAIIYGWSTVPZ-QFIPXVFZSA-N 1 1 381.495 3.441 10 0 GGAEMO CN(C)c1ccc2c(c1)CN(C(=O)[C@@H]1CCC[N@H+]1Cc1ccc(F)cc1)CC2 ZINC000225427854 570573288 /nfs/dbraw/zinc/57/32/88/570573288.db2.gz KGAAIIYGWSTVPZ-QFIPXVFZSA-N 1 1 381.495 3.441 10 0 GGAEMO CCN(CC)C(=O)[C@H](C1CCCC1)[NH+]1CCN(C(=O)c2ccc(C)cc2)CC1 ZINC000036250124 570585197 /nfs/dbraw/zinc/58/51/97/570585197.db2.gz UUSOSMXKSGEXKR-NRFANRHFSA-N 1 1 385.552 3.180 10 0 GGAEMO CCN(CC)C(=O)[C@H](C1CCCC1)[NH+]1CCN(C(=O)c2ccccc2F)CC1 ZINC000036250132 570585367 /nfs/dbraw/zinc/58/53/67/570585367.db2.gz ICJAGFOCPYGKHL-FQEVSTJZSA-N 1 1 389.515 3.011 10 0 GGAEMO CC(C)NC(=O)[C@@H](C1CCCC1)[NH+]1CCN(C(=O)Nc2ccc(F)cc2)CC1 ZINC000036310430 570608781 /nfs/dbraw/zinc/60/87/81/570608781.db2.gz ILPLIZYPPMSCQA-LJQANCHMSA-N 1 1 390.503 3.059 10 0 GGAEMO Cc1nc2ccccn2c(=O)c1CC[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCO2 ZINC000225846361 570625755 /nfs/dbraw/zinc/62/57/55/570625755.db2.gz RLNOQKOOWJOEQL-LJQANCHMSA-N 1 1 391.471 3.154 10 0 GGAEMO COc1ccccc1[C@@H](CNC(=O)c1cc(Cl)c(OC)c(OC)c1)[NH+](C)C ZINC000006862583 570653633 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393.520 3.205 10 0 GGAEMO CCCC[NH+]1CCN(C(=O)c2nc3nc(C)cc(C)c3c(N(CC)CC)n2)CC1 ZINC000096396824 1410330919 /nfs/dbraw/zinc/33/09/19/1410330919.db2.gz MYIZEQAOCMTYEN-UHFFFAOYSA-N 1 1 398.555 3.046 10 0 GGAEMO O=C(NCCC[NH+]1CCOCC1)c1nc2ccccn2c1-c1ccc(Cl)cc1 ZINC000097161510 1410355966 /nfs/dbraw/zinc/35/59/66/1410355966.db2.gz YYPUDRMDPNMYJX-UHFFFAOYSA-N 1 1 398.894 3.107 10 0 GGAEMO O=C(Nc1ccc(N2CCOCC2)c(F)c1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000097543453 1410373928 /nfs/dbraw/zinc/37/39/28/1410373928.db2.gz CJACUGDFQKSKSM-UHFFFAOYSA-N 1 1 398.482 3.012 10 0 GGAEMO C[NH+]1CCN(C(=O)Cc2ccc(NCc3csc(C(C)(C)C)n3)cc2)CC1 ZINC000098171983 1410436243 /nfs/dbraw/zinc/43/62/43/1410436243.db2.gz BOAYDKBSIOFRBC-UHFFFAOYSA-N 1 1 386.565 3.369 10 0 GGAEMO CCCN(C(=O)NCCc1cnn(C)c1)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000101793909 1410503360 /nfs/dbraw/zinc/50/33/60/1410503360.db2.gz DOXHEQORVFRHPK-NRFANRHFSA-N 1 1 383.540 3.049 10 0 GGAEMO COc1ccccc1C[N@@H+](CCO)C[C@H](O)COc1cccc2ccccc21 ZINC000103143942 1410831364 /nfs/dbraw/zinc/83/13/64/1410831364.db2.gz BDKPWRZKNGTQHJ-FQEVSTJZSA-N 1 1 381.472 3.083 10 0 GGAEMO Cn1cc(C[NH2+]C[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c(-c2ccncc2)n1 ZINC000103173665 1410834308 /nfs/dbraw/zinc/83/43/08/1410834308.db2.gz BFEUZOCHVTYXRM-FQEVSTJZSA-N 1 1 375.520 3.136 10 0 GGAEMO Cn1cc(CNC[C@@H]2CC[N@H+](CCc3ccccc3)C2)c(-c2ccncc2)n1 ZINC000103173665 1410834311 /nfs/dbraw/zinc/83/43/11/1410834311.db2.gz BFEUZOCHVTYXRM-FQEVSTJZSA-N 1 1 375.520 3.136 10 0 GGAEMO Cn1cc(CNC[C@@H]2CC[N@@H+](CCc3ccccc3)C2)c(-c2ccncc2)n1 ZINC000103173665 1410834313 /nfs/dbraw/zinc/83/43/13/1410834313.db2.gz BFEUZOCHVTYXRM-FQEVSTJZSA-N 1 1 375.520 3.136 10 0 GGAEMO Cc1oc2c(c1C(=O)N1CCC[N@H+](C)CC1)CN(Cc1ccc(C)cc1)CC2 ZINC000105111476 1411030504 /nfs/dbraw/zinc/03/05/04/1411030504.db2.gz QTLJCFKXJWQKDP-UHFFFAOYSA-N 1 1 381.520 3.232 10 0 GGAEMO CCN1CCN(C[C@@H](C)C[NH2+]Cc2ccc(-n3cnc4ccccc43)cc2)CC1 ZINC000105441917 1411066323 /nfs/dbraw/zinc/06/63/23/1411066323.db2.gz DHJYMNIFPDYWMS-FQEVSTJZSA-N 1 1 391.563 3.389 10 0 GGAEMO COc1ccc(C[NH2+]Cc2ccc(N3CCO[C@H](C)C3)nc2)c(Cl)c1OC ZINC000107315243 1411360811 /nfs/dbraw/zinc/36/08/11/1411360811.db2.gz DKHWMXHISXEHRH-CQSZACIVSA-N 1 1 391.899 3.267 10 0 GGAEMO Cc1oc2c(c1C(=O)N1CC[NH+](C(C)C)CC1)CN(Cc1cccc(F)c1)CC2 ZINC000107472713 1411381205 /nfs/dbraw/zinc/38/12/05/1411381205.db2.gz OSVBVBDRBSRELQ-UHFFFAOYSA-N 1 1 399.510 3.452 10 0 GGAEMO CC[NH+]1CCN(CCCCNC(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)CC1 ZINC000107780409 1411410909 /nfs/dbraw/zinc/41/09/09/1411410909.db2.gz FYXNDSNHYPRUNS-XZOQPEGZSA-N 1 1 379.548 3.477 10 0 GGAEMO COC(=O)c1ccc(C[NH+]2CCC(N(C)C(=O)OC(C)(C)C)CC2)cc1F ZINC000177070426 1428576694 /nfs/dbraw/zinc/57/66/94/1428576694.db2.gz JEYLOQWUKRFHOD-UHFFFAOYSA-N 1 1 380.460 3.444 10 0 GGAEMO CC(=O)NCCC[N@H+]1CCc2c(cccc2NC(=O)Nc2ccc(F)cc2)C1 ZINC000109134471 1411691619 /nfs/dbraw/zinc/69/16/19/1411691619.db2.gz FTLFUDITANXANZ-UHFFFAOYSA-N 1 1 384.455 3.354 10 0 GGAEMO Cc1ccc(-c2nnco2)cc1NC(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000110076752 1411830126 /nfs/dbraw/zinc/83/01/26/1411830126.db2.gz CZJQAYKZRBXTTP-UHFFFAOYSA-N 1 1 377.448 3.395 10 0 GGAEMO CC(C)[C@@H](CO)[N@@H+](CC(=O)Nc1ccnn1C1CCCC1)Cc1ccccc1 ZINC000112658011 1412187159 /nfs/dbraw/zinc/18/71/59/1412187159.db2.gz HZUFVJSIOKPXSY-HXUWFJFHSA-N 1 1 384.524 3.456 10 0 GGAEMO C[NH+](C)C[C@H](NS(=O)(=O)Cc1ccccc1C(F)(F)F)c1ccccc1 ZINC000113275043 1412287453 /nfs/dbraw/zinc/28/74/53/1412287453.db2.gz XOONQPMVABFHHB-KRWDZBQOSA-N 1 1 386.439 3.428 10 0 GGAEMO CCC[N@H+](CC(=O)Nc1ccc(F)c(F)c1F)Cc1cccc(C(=O)NC)c1 ZINC000113928528 1412353428 /nfs/dbraw/zinc/35/34/28/1412353428.db2.gz GXJMOKOJWZJRRA-UHFFFAOYSA-N 1 1 393.409 3.314 10 0 GGAEMO CCC[N@@H+](CC(=O)Nc1ccc(F)c(F)c1F)Cc1cccc(C(=O)NC)c1 ZINC000113928528 1412353435 /nfs/dbraw/zinc/35/34/35/1412353435.db2.gz GXJMOKOJWZJRRA-UHFFFAOYSA-N 1 1 393.409 3.314 10 0 GGAEMO C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCC[N@H+]1C[C@@H](O)COCc1ccccc1 ZINC000114562753 1412461291 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BEZTVPWAKCSFBC-INIZCTEOSA-N 1 1 376.501 3.414 10 0 GGAEMO CNC(=O)c1cccc(NC(=O)[C@H](C)[NH+]2CCC(Oc3ccc(C)cc3)CC2)c1 ZINC000116883076 1412948475 /nfs/dbraw/zinc/94/84/75/1412948475.db2.gz AOZKVMXSFCNSLU-KRWDZBQOSA-N 1 1 395.503 3.225 10 0 GGAEMO Cn1ccc(N2CCC[C@H]([NH2+]Cc3cc(C(F)(F)F)ccc3Cl)C2=O)n1 ZINC000119386587 1413431575 /nfs/dbraw/zinc/43/15/75/1413431575.db2.gz GAFRVJPDKYPNAI-AWEZNQCLSA-N 1 1 386.805 3.378 10 0 GGAEMO Cc1ncc(CNc2cccc(C[N@H+]3CCC[C@H]3C(N)=O)c2)n1-c1ccccc1 ZINC000120037606 1413663242 /nfs/dbraw/zinc/66/32/42/1413663242.db2.gz DMVRWKVDHBQZOH-QFIPXVFZSA-N 1 1 389.503 3.243 10 0 GGAEMO CCN(C(=O)C[N@@H+]1CC[C@H](C)[C@H](n2ccnc2)C1)c1nc2ccccc2s1 ZINC000120217826 1413735889 /nfs/dbraw/zinc/73/58/89/1413735889.db2.gz GQOOBVDTDLJVMK-DOTOQJQBSA-N 1 1 383.521 3.429 10 0 GGAEMO CCN(C(=O)C[N@H+]1CC[C@H](C)[C@H](n2ccnc2)C1)c1nc2ccccc2s1 ZINC000120217826 1413735904 /nfs/dbraw/zinc/73/59/04/1413735904.db2.gz GQOOBVDTDLJVMK-DOTOQJQBSA-N 1 1 383.521 3.429 10 0 GGAEMO C[C@@H](NC(=O)[C@H](C)[NH+]1CCC(N2CCCCC2=O)CC1)c1ccc(Cl)cc1 ZINC000120250566 1413752686 /nfs/dbraw/zinc/75/26/86/1413752686.db2.gz GZGZEPVPQRFZTH-CVEARBPZSA-N 1 1 391.943 3.383 10 0 GGAEMO c1ccc(CCN2CCC([NH2+]C[C@H](c3ccccc3)N3CCOCC3)CC2)cc1 ZINC000120623575 1413858316 /nfs/dbraw/zinc/85/83/16/1413858316.db2.gz FEYABVYXBYMTRV-RUZDIDTESA-N 1 1 393.575 3.357 10 0 GGAEMO CC(C)(C)[C@H]([NH2+]Cc1cccc(OC(F)F)c1)c1nc(-c2nc[nH]n2)no1 ZINC000120949490 1413957243 /nfs/dbraw/zinc/95/72/43/1413957243.db2.gz CMINDKGQNXFERD-GFCCVEGCSA-N 1 1 378.383 3.333 10 0 GGAEMO CNC(=O)c1cccc(NC(=O)[C@H](C)[N@H+]2C[C@@H](c3ccc(F)cc3)C[C@H]2C)c1 ZINC000121429824 1414119035 /nfs/dbraw/zinc/11/90/35/1414119035.db2.gz ICVNNXCBTMBWEU-VKJFTORMSA-N 1 1 383.467 3.390 10 0 GGAEMO C[C@@H]1CCC[N@@H+](CCNC(=O)NCc2ccc(OCc3ccccn3)cc2)C1 ZINC000122168823 1414378766 /nfs/dbraw/zinc/37/87/66/1414378766.db2.gz DQEWMXKNULAFJM-GOSISDBHSA-N 1 1 382.508 3.192 10 0 GGAEMO C[C@H]1CCC[N@@H+](CCNC(=O)NCc2ccc(OCc3ccccn3)cc2)C1 ZINC000122169078 1414378813 /nfs/dbraw/zinc/37/88/13/1414378813.db2.gz DQEWMXKNULAFJM-SFHVURJKSA-N 1 1 382.508 3.192 10 0 GGAEMO CCC(=O)N1CCC[N@@H+]([C@@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)CC1 ZINC000122734562 1414552249 /nfs/dbraw/zinc/55/22/49/1414552249.db2.gz HIBFILRIIDIMBM-ROUUACIJSA-N 1 1 381.520 3.350 10 0 GGAEMO CCC(=O)N1CCC[N@H+]([C@@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)CC1 ZINC000122734562 1414552253 /nfs/dbraw/zinc/55/22/53/1414552253.db2.gz HIBFILRIIDIMBM-ROUUACIJSA-N 1 1 381.520 3.350 10 0 GGAEMO Cc1cnn([C@@H]2CCC[N@@H+](Cc3ccccc3OCC(=O)N3CCCC3)C2)c1 ZINC000123081732 1414636260 /nfs/dbraw/zinc/63/62/60/1414636260.db2.gz GXMXEVROVMEOBT-HXUWFJFHSA-N 1 1 382.508 3.030 10 0 GGAEMO O=C(NCCc1cc2ccccc2[nH]1)N1CCN(c2cc[nH+]cc2Cl)CC1 ZINC000123276569 1414684869 /nfs/dbraw/zinc/68/48/69/1414684869.db2.gz UGYBHTBRWWOBRY-UHFFFAOYSA-N 1 1 383.883 3.291 10 0 GGAEMO CCN(C(C)=O)c1nc(C[NH2+]C[C@H](C)c2nc(-c3ccccc3)no2)cs1 ZINC000123448924 1414735457 /nfs/dbraw/zinc/73/54/57/1414735457.db2.gz BUJXUTKEELSMNA-ZDUSSCGKSA-N 1 1 385.493 3.459 10 0 GGAEMO Cc1nn(-c2ccccc2)cc1C(=O)N1CCN(c2cc[nH+]cc2Cl)CC1 ZINC000123483587 1414747494 /nfs/dbraw/zinc/74/74/94/1414747494.db2.gz LPWFVPVAGJTPAS-UHFFFAOYSA-N 1 1 381.867 3.192 10 0 GGAEMO CCC(C)(C)C1CCC2(CC1)NC(=O)N(C[N@@H+](C)CC1CCOCC1)C2=O ZINC000124763892 1415039308 /nfs/dbraw/zinc/03/93/08/1415039308.db2.gz DYRBPOWMKNKOMV-UHFFFAOYSA-N 1 1 379.545 3.219 10 0 GGAEMO C[C@H](Nc1ccc([NH+]2CCC(C)CC2)cc1)C(=O)NC(=O)NCC(F)(F)F ZINC000124782447 1415043019 /nfs/dbraw/zinc/04/30/19/1415043019.db2.gz HMRQLVBAULKKJT-ZDUSSCGKSA-N 1 1 386.418 3.111 10 0 GGAEMO COC(=O)Nc1ccc(CNC(=O)N[C@@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cc1 ZINC000125103726 1415109514 /nfs/dbraw/zinc/10/95/14/1415109514.db2.gz DYKNOFKXBNPXPC-OXQOHEQNSA-N 1 1 396.491 3.327 10 0 GGAEMO Cc1ccc(-c2ncc(C[NH2+]Cc3ccccc3S(=O)(=O)N(C)C)s2)o1 ZINC000125382236 1415181706 /nfs/dbraw/zinc/18/17/06/1415181706.db2.gz ANXLRNPYUFQGQB-UHFFFAOYSA-N 1 1 391.518 3.252 10 0 GGAEMO Cn1cc(C[N@H+]2CCC[C@H]2CN2CCOCC2)c(-c2cc3ccccc3o2)n1 ZINC000125703990 1415257872 /nfs/dbraw/zinc/25/78/72/1415257872.db2.gz AKTCTYZMKAIKCH-IBGZPJMESA-N 1 1 380.492 3.130 10 0 GGAEMO CC[C@H](C)[C@H]([NH2+]CC(=O)Nc1nc(-c2c(C)cc(C)cc2C)cs1)C(N)=O ZINC000126464346 1415459941 /nfs/dbraw/zinc/45/99/41/1415459941.db2.gz CZKVNDRBPGYYPG-SGTLLEGYSA-N 1 1 388.537 3.163 10 0 GGAEMO C[C@H](Nc1ccc([NH+]2CCCCC2)cc1)C(=O)NC[C@H]1COc2ccccc2O1 ZINC000126491293 1415469485 /nfs/dbraw/zinc/46/94/85/1415469485.db2.gz BOSOKVKZGFQQSS-PXNSSMCTSA-N 1 1 395.503 3.434 10 0 GGAEMO C[C@@H](Nc1ccc([NH+]2CCCCC2)cc1)C(=O)NC[C@H]1COc2ccccc2O1 ZINC000126491538 1415469623 /nfs/dbraw/zinc/46/96/23/1415469623.db2.gz BOSOKVKZGFQQSS-XLIONFOSSA-N 1 1 395.503 3.434 10 0 GGAEMO CC[N@@H+](Cc1c(C)nn(C)c1N1CCOCC1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000128423938 1415983906 /nfs/dbraw/zinc/98/39/06/1415983906.db2.gz WGJPUKRNEXXYBV-KRWDZBQOSA-N 1 1 386.540 3.027 10 0 GGAEMO COc1cc(OC)c(OC)cc1C[NH2+]Cc1cccnc1OCC(F)(F)F ZINC000128841437 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CCC[C@@H]([NH3+])c1nc(-c2ncc(Br)cc2Br)no1 ZINC000139936575 1417481810 /nfs/dbraw/zinc/48/18/10/1417481810.db2.gz VROLRUVYPGFQEZ-MRVPVSSYSA-N 1 1 376.052 3.457 10 0 GGAEMO O=C(COc1ccc(C(F)(F)F)cc1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000148606750 1417766425 /nfs/dbraw/zinc/76/64/25/1417766425.db2.gz BQOFJQJPGKQRLK-UHFFFAOYSA-N 1 1 378.394 3.429 10 0 GGAEMO C[C@H](c1ccc(NC(=O)N[C@H](CCO)c2ccccc2)cc1)[NH+]1CCOCC1 ZINC000151573078 1418028890 /nfs/dbraw/zinc/02/88/90/1418028890.db2.gz GSENVNWUVCHQGB-DYESRHJHSA-N 1 1 383.492 3.325 10 0 GGAEMO CNC(=O)c1cccc(NC(=O)[C@H](C)[N@H+]2CC=C(c3cccc(C)c3)CC2)c1 ZINC000179402076 1429360714 /nfs/dbraw/zinc/36/07/14/1429360714.db2.gz CZEXEAOJQRGZEZ-KRWDZBQOSA-N 1 1 377.488 3.471 10 0 GGAEMO CNC(=O)c1cccc(NC(=O)[C@H](C)[N@@H+]2CC=C(c3cccc(C)c3)CC2)c1 ZINC000179402076 1429360720 /nfs/dbraw/zinc/36/07/20/1429360720.db2.gz CZEXEAOJQRGZEZ-KRWDZBQOSA-N 1 1 377.488 3.471 10 0 GGAEMO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(F)cc1Cl ZINC000179563482 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395.547 3.305 10 0 GGAEMO O=C(C[NH2+]Cc1cc(Cl)ccc1OC[C@@H]1CCCO1)NC1CCCCC1 ZINC000174424179 1427150956 /nfs/dbraw/zinc/15/09/56/1427150956.db2.gz FQVCNVRPFNABQP-SFHVURJKSA-N 1 1 380.916 3.436 10 0 GGAEMO COc1c(C)c[nH+]c(CN2CCC(N(C)C(=O)[C@H](C)c3cccnc3)CC2)c1C ZINC000174611180 1427261279 /nfs/dbraw/zinc/26/12/79/1427261279.db2.gz QUNBEECSQMMPBH-QGZVFWFLSA-N 1 1 396.535 3.329 10 0 GGAEMO Cc1nnc(SCCC(=O)Nc2cccc(C[NH+]3CCSCC3)c2C)[nH]1 ZINC000174675641 1427303728 /nfs/dbraw/zinc/30/37/28/1427303728.db2.gz BDHROBHGHZZBGJ-UHFFFAOYSA-N 1 1 391.566 3.091 10 0 GGAEMO Cc1nnc(SCCC(=O)NCC2([NH2+][C@@H](C)c3ccccc3)CCCC2)[nH]1 ZINC000174841547 1427400163 /nfs/dbraw/zinc/40/01/63/1427400163.db2.gz BYSSLEGIQLUORR-HNNXBMFYSA-N 1 1 387.553 3.375 10 0 GGAEMO Cc1nnc(-c2cccc(C(=O)N3CC[N@@H+](Cc4ccccc4)C[C@@H]3C)c2)o1 ZINC000175045668 1427516982 /nfs/dbraw/zinc/51/69/82/1427516982.db2.gz AZVHCXSKMSFISH-INIZCTEOSA-N 1 1 376.460 3.392 10 0 GGAEMO Cc1nnc(-c2cccc(C(=O)N3CC[N@H+](Cc4ccccc4)C[C@@H]3C)c2)o1 ZINC000175045668 1427516988 /nfs/dbraw/zinc/51/69/88/1427516988.db2.gz AZVHCXSKMSFISH-INIZCTEOSA-N 1 1 376.460 3.392 10 0 GGAEMO Cc1cccc(C[NH+]2CCN(C(=O)Nc3ccc4c(c3)N(C)CCO4)CC2)c1 ZINC000175085383 1427538316 /nfs/dbraw/zinc/53/83/16/1427538316.db2.gz GSQBQNRLDKMZAJ-UHFFFAOYSA-N 1 1 380.492 3.173 10 0 GGAEMO C[C@H](NC(=O)NCC[N@@H+](C)Cc1ccccc1)c1ccc(-n2cccn2)cc1 ZINC000175816397 1427908553 /nfs/dbraw/zinc/90/85/53/1427908553.db2.gz CWVXILXZYBESKJ-SFHVURJKSA-N 1 1 377.492 3.365 10 0 GGAEMO CCCn1cc(C[N@@H+]2CCCN(C(=O)Nc3ccc4c(c3)N(C)CC4)CC2)cn1 ZINC000180200887 1429800324 /nfs/dbraw/zinc/80/03/24/1429800324.db2.gz FGMMPKVYNAEEDN-UHFFFAOYSA-N 1 1 396.539 3.025 10 0 GGAEMO CCCn1cc(C[N@H+]2CCCN(C(=O)Nc3ccc4c(c3)N(C)CC4)CC2)cn1 ZINC000180200887 1429800327 /nfs/dbraw/zinc/80/03/27/1429800327.db2.gz FGMMPKVYNAEEDN-UHFFFAOYSA-N 1 1 396.539 3.025 10 0 GGAEMO Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)[N@@H+](C)C[C@@H]1CCCC[C@@H]1O ZINC000181471030 1430306870 /nfs/dbraw/zinc/30/68/70/1430306870.db2.gz AWAUOGSYBUJFIE-BJLQDIEVSA-N 1 1 384.524 3.299 10 0 GGAEMO C[C@@H](NC(=O)[C@@H](C)[NH+]1CCC(CC(=O)N(C)C)CC1)c1cc2ccccc2o1 ZINC000182183679 1430426036 /nfs/dbraw/zinc/42/60/36/1430426036.db2.gz BYUMDPAMRZFKHT-HZPDHXFCSA-N 1 1 385.508 3.189 10 0 GGAEMO C[C@H](NC(=O)[C@H](C)[NH+]1CCC(CC(=O)N(C)C)CC1)c1cc2ccccc2o1 ZINC000182183700 1430426096 /nfs/dbraw/zinc/42/60/96/1430426096.db2.gz BYUMDPAMRZFKHT-HOTGVXAUSA-N 1 1 385.508 3.189 10 0 GGAEMO Cc1c(C)n(Cc2ccco2)c2nc[nH+]c(NC[C@@H]3COC4(CCOCC4)O3)c12 ZINC000182264611 1430439822 /nfs/dbraw/zinc/43/98/22/1430439822.db2.gz GJDKEVARDFNOAP-QGZVFWFLSA-N 1 1 398.463 3.023 10 0 GGAEMO Cn1cc([C@H](CNC(=O)N2CCc3ccc(C(C)(C)C)cc3C2)[NH+](C)C)cn1 ZINC000182646536 1430509042 /nfs/dbraw/zinc/50/90/42/1430509042.db2.gz ULLQBNWZDLDZCS-FQEVSTJZSA-N 1 1 383.540 3.088 10 0 GGAEMO C[C@H]1CCCC[N@H+]1Cc1ccccc1CNC(=O)c1ccc2nnn(C)c2c1 ZINC000182768295 1430536469 /nfs/dbraw/zinc/53/64/69/1430536469.db2.gz XNFONGDIYOMNAW-INIZCTEOSA-N 1 1 377.492 3.273 10 0 GGAEMO C[C@H](NC(=O)N1CCN(c2ccc(F)cc2)CC1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000182942856 1430577430 /nfs/dbraw/zinc/57/74/30/1430577430.db2.gz AQINWCDNCZZMSP-ZWKOTPCHSA-N 1 1 388.531 3.310 10 0 GGAEMO CC[NH+](CC)CCOc1ccccc1NC(=O)N1CCCC[C@H]1c1nnc[nH]1 ZINC000183066233 1430603975 /nfs/dbraw/zinc/60/39/75/1430603975.db2.gz VXHHBDPQLZSKJY-KRWDZBQOSA-N 1 1 386.500 3.284 10 0 GGAEMO Cc1cnc(C(C)(C)N[C@H](C)C(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000183921997 1430813671 /nfs/dbraw/zinc/81/36/71/1430813671.db2.gz CHQJBEISDTWZND-AEFFLSMTSA-N 1 1 386.565 3.055 10 0 GGAEMO COc1ccc(C[N@H+]2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@H]3C2)c(OC)c1 ZINC000184240955 1430861136 /nfs/dbraw/zinc/86/11/36/1430861136.db2.gz UVIYBWXVIVPXMZ-WBAXXEDZSA-N 1 1 376.497 3.439 10 0 GGAEMO Oc1ccc2cc(Br)ccc2c1C[N@H+]1CCO[C@@]2(CCOC2)C1 ZINC000184292185 1430869262 /nfs/dbraw/zinc/86/92/62/1430869262.db2.gz PJEZUUZZHCKORM-SFHVURJKSA-N 1 1 378.266 3.299 10 0 GGAEMO CC[NH+](CC)CCOc1ccc(NC(=O)N2CCCC[C@@H]2c2nnc[nH]2)cc1 ZINC000185258383 1431095164 /nfs/dbraw/zinc/09/51/64/1431095164.db2.gz MXWFUFJWOHVAHG-GOSISDBHSA-N 1 1 386.500 3.284 10 0 GGAEMO Cc1nc(C[NH+]2CCC(C(=O)Nc3cccc4c3OCC[C@H]4O)CC2)cs1 ZINC000185279896 1431098941 /nfs/dbraw/zinc/09/89/41/1431098941.db2.gz VATSHDVVXPAZRZ-GOSISDBHSA-N 1 1 387.505 3.118 10 0 GGAEMO COC(=O)c1ccc(C)c(NC(=O)[C@H](C)[NH+]2CCC(O)(c3ccccc3)CC2)c1 ZINC000185514431 1431162362 /nfs/dbraw/zinc/16/23/62/1431162362.db2.gz CGFWFWOOGMZECP-KRWDZBQOSA-N 1 1 396.487 3.092 10 0 GGAEMO CC(=O)Nc1cccc(NC(=O)[C@H](C)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)c1 ZINC000185714434 1431214137 /nfs/dbraw/zinc/21/41/37/1431214137.db2.gz DWTCZDPNYZSBKD-BQFCYCMXSA-N 1 1 386.540 3.215 10 0 GGAEMO CCOC(=O)c1nn(C)cc1CNCc1ccc(C[N@H+]2CCC[C@H](C)C2)cc1 ZINC000186309209 1431378347 /nfs/dbraw/zinc/37/83/47/1431378347.db2.gz CDHPNSATNGYRDU-KRWDZBQOSA-N 1 1 384.524 3.119 10 0 GGAEMO O=C(c1cc(-c2cccs2)[nH]n1)N(Cc1ccccn1)[C@@H]1CCC[NH2+]CC1 ZINC000186599957 1431464859 /nfs/dbraw/zinc/46/48/59/1431464859.db2.gz 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392.525 3.075 10 0 GGAEMO CCOC(=O)c1sc2nc(C[NH+](C)C)nc(N[C@H]3CCOC[C@@H]3C)c2c1C ZINC000277358402 1435298207 /nfs/dbraw/zinc/29/82/07/1435298207.db2.gz DTHVTPQTSWGAFW-AAEUAGOBSA-N 1 1 392.525 3.075 10 0 GGAEMO CCC[C@]1(COC)CCC[N@@H+]1Cc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1 ZINC000278050574 1435353883 /nfs/dbraw/zinc/35/38/83/1435353883.db2.gz DHHNOAJAVFAQAT-OAQYLSRUSA-N 1 1 381.480 3.302 10 0 GGAEMO CCC[C@]1(COC)CCC[N@H+]1Cc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1 ZINC000278050574 1435353886 /nfs/dbraw/zinc/35/38/86/1435353886.db2.gz DHHNOAJAVFAQAT-OAQYLSRUSA-N 1 1 381.480 3.302 10 0 GGAEMO C[C@H](C(=O)N(C)Cc1c(F)cccc1Cl)[N@@H+]1C[C@H](C)OC2(CCOCC2)C1 ZINC000279658396 1435525401 /nfs/dbraw/zinc/52/54/01/1435525401.db2.gz CILFCXQIHLVPDY-LSDHHAIUSA-N 1 1 398.906 3.096 10 0 GGAEMO C[C@H](C(=O)N(C)Cc1c(F)cccc1Cl)[N@H+]1C[C@H](C)OC2(CCOCC2)C1 ZINC000279658396 1435525402 /nfs/dbraw/zinc/52/54/02/1435525402.db2.gz CILFCXQIHLVPDY-LSDHHAIUSA-N 1 1 398.906 3.096 10 0 GGAEMO COc1ccccc1S(=O)(=O)CCC[N@H+]1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@H]1O ZINC000281293767 1435802777 /nfs/dbraw/zinc/80/27/77/1435802777.db2.gz HAXIHVMZHHDAKI-FCGDIQPGSA-N 1 1 395.565 3.121 10 0 GGAEMO Cc1[nH+]ccn1CCCCNC(=O)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl ZINC000283180968 1435878161 /nfs/dbraw/zinc/87/81/61/1435878161.db2.gz ABBQVJFOQXVRFC-GFCCVEGCSA-N 1 1 397.306 3.272 10 0 GGAEMO Cc1nn(-c2ccncc2)cc1C[NH2+][C@@H](Cc1ccccc1)[C@H](O)C(F)(F)F ZINC000680121100 1126105660 /nfs/dbraw/zinc/10/56/60/1126105660.db2.gz QYMJUBHYXDSRSS-OALUTQOASA-N 1 1 390.409 3.200 10 0 GGAEMO COc1cc(-c2noc(C[NH2+][C@](C)(CO)Cc3ccc(F)cc3)n2)ccc1C ZINC001176599620 1126150377 /nfs/dbraw/zinc/15/03/77/1126150377.db2.gz PHDCOYRQMSQTNY-NRFANRHFSA-N 1 1 385.439 3.276 10 0 GGAEMO C[C@@](CO)(Cc1ccccc1F)[NH2+]Cc1nc2c3ccccc3oc2c(=O)[nH]1 ZINC001460858439 1126192403 /nfs/dbraw/zinc/19/24/03/1126192403.db2.gz BVCLTZPAJFGEKG-NRFANRHFSA-N 1 1 381.407 3.304 10 0 GGAEMO C[C@](CO)(Cc1ccccc1F)[NH2+]Cc1nc2c3ccccc3oc2c(=O)[nH]1 ZINC001460858441 1126192415 /nfs/dbraw/zinc/19/24/15/1126192415.db2.gz BVCLTZPAJFGEKG-OAQYLSRUSA-N 1 1 381.407 3.304 10 0 GGAEMO C[C@](CO)(Cc1ccc(F)cc1)[NH2+]Cc1nc(-c2cc(F)c(F)c(F)c2)no1 ZINC001620625468 1126242646 /nfs/dbraw/zinc/24/26/46/1126242646.db2.gz URIVYDJAJXIQJX-LJQANCHMSA-N 1 1 395.356 3.376 10 0 GGAEMO C[C@](CO)(Cc1ccc(F)cc1)[NH2+]Cc1noc(-c2ccc(F)cc2F)n1 ZINC001648466973 1126250686 /nfs/dbraw/zinc/25/06/86/1126250686.db2.gz SXGJLTNKEVJDRI-LJQANCHMSA-N 1 1 377.366 3.237 10 0 GGAEMO C[C@@](CO)(Cc1ccccc1F)[NH2+]Cc1nc(-c2cc(F)c(F)c(F)c2)no1 ZINC001654936545 1126254501 /nfs/dbraw/zinc/25/45/01/1126254501.db2.gz VZZDGMBQYRQBGT-IBGZPJMESA-N 1 1 395.356 3.376 10 0 GGAEMO C[C@@H]1CCC[N@@H+](CCCNC(=O)NC[C@H]2CCN(c3ccc(F)cc3)C2)C1 ZINC000241739157 231039702 /nfs/dbraw/zinc/03/97/02/231039702.db2.gz RAMHNLBSPBXCDI-QZTJIDSGSA-N 1 1 376.520 3.073 10 0 GGAEMO CC(C)n1cc2c3c1cccc3[C@H]1C[C@@H](C(=O)O[C@@H](C)[C@@H](C)O)C[N@H+](C)[C@@H]1C2 ZINC000003873168 204021616 /nfs/dbraw/zinc/02/16/16/204021616.db2.gz JQYLIGHHVGCTPR-UNYZBHEASA-N 1 1 384.520 3.495 10 0 in-vivo GGAEMO C[NH+]1CCN(C(=O)c2ccc(CNc3[nH]c(=S)nc4ccccc43)cc2)CC1 ZINC000004658067 204060989 /nfs/dbraw/zinc/06/09/89/204060989.db2.gz YMGDTWLWVVRLOI-UHFFFAOYSA-N 1 1 393.516 3.292 10 0 GGAEMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2cc3c(c4ccccc4[nH]c3=O)n2C)C1 ZINC000004930683 204091707 /nfs/dbraw/zinc/09/17/07/204091707.db2.gz HMTNZOGZNYHIEQ-IYBDPMFKSA-N 1 1 394.519 3.118 10 0 GGAEMO C[NH+]1CCN(c2ccc(-c3cccc(NC(=O)c4ccc(F)cc4)c3)nn2)CC1 ZINC000004939849 204094922 /nfs/dbraw/zinc/09/49/22/204094922.db2.gz QZRWEEPZKMQRCV-UHFFFAOYSA-N 1 1 391.450 3.287 10 0 GGAEMO C[C@H]1CCC[N@@H+](CCCNC(=O)c2ccc(C[S@@](=O)c3ccccc3)o2)C1 ZINC000006772078 204203886 /nfs/dbraw/zinc/20/38/86/204203886.db2.gz LRKHJEYGOVZLTN-SOKVYYICSA-N 1 1 388.533 3.439 10 0 GGAEMO CCOc1ccc(C[N@@H+](C)C[C@@H](O)COCc2ccc(OC)cc2)cc1OC ZINC000006787514 204205707 /nfs/dbraw/zinc/20/57/07/204205707.db2.gz DUAQFJCCMHHOJY-LJQANCHMSA-N 1 1 389.492 3.112 10 0 GGAEMO COc1ccccc1[C@H](CNC(=O)c1cc(Cl)c(OC)c(OC)c1)[NH+](C)C ZINC000006862581 204216817 /nfs/dbraw/zinc/21/68/17/204216817.db2.gz GRCUGKRQYRVTLC-INIZCTEOSA-N 1 1 392.883 3.399 10 0 GGAEMO CCOC(=O)[C@@H]1CCC[N@@H+](C[C@@H](O)COc2ccc(OC)cc2C(C)(C)C)C1 ZINC000006576722 204185419 /nfs/dbraw/zinc/18/54/19/204185419.db2.gz WATXPUBQTSDBQD-IAGOWNOFSA-N 1 1 393.524 3.008 10 0 GGAEMO O=C(NCC[NH+]1CCCC1)c1ccc(C[S@](=O)Cc2ccccc2Cl)o1 ZINC000006895864 204221630 /nfs/dbraw/zinc/22/16/30/204221630.db2.gz UOKBBWBNULMPGK-SANMLTNESA-N 1 1 394.924 3.208 10 0 GGAEMO O=C(C[N@@H+]1CCC[C@@H]1c1ccc2c(c1)OCCCO2)NCCc1ccccc1F ZINC000007684707 204246646 /nfs/dbraw/zinc/24/66/46/204246646.db2.gz YMYNYYTYKNIVJC-HXUWFJFHSA-N 1 1 398.478 3.483 10 0 GGAEMO O=C(C[N@H+]1CCC[C@@H]1c1ccc2c(c1)OCCCO2)NCCc1ccccc1F ZINC000007684707 204246649 /nfs/dbraw/zinc/24/66/49/204246649.db2.gz YMYNYYTYKNIVJC-HXUWFJFHSA-N 1 1 398.478 3.483 10 0 GGAEMO CN(C)S(=O)(=O)c1ccc(OCC[N@@H+]2CC=C(c3ccccc3)CC2)cc1 ZINC000008745890 204287188 /nfs/dbraw/zinc/28/71/88/204287188.db2.gz VZDYXFZJYYAKGB-UHFFFAOYSA-N 1 1 386.517 3.105 10 0 GGAEMO C[C@H](C(=O)NC(=O)NC1CCCCC1)[N@@H+](C)CCOc1ccc(Cl)cc1 ZINC000008120601 204262187 /nfs/dbraw/zinc/26/21/87/204262187.db2.gz GLTNDLFWYIRHSI-CQSZACIVSA-N 1 1 381.904 3.198 10 0 GGAEMO C[C@H](C(=O)Nc1ccc2c(c1)CCC2)[N@H+](C)Cc1ccccc1N1CCOCC1 ZINC000008156752 204264387 /nfs/dbraw/zinc/26/43/87/204264387.db2.gz AGAUWNCOVNCAJK-GOSISDBHSA-N 1 1 393.531 3.471 10 0 GGAEMO C[C@H](C(=O)Nc1ccc2c(c1)CCC2)[N@@H+](C)Cc1ccccc1N1CCOCC1 ZINC000008156752 204264390 /nfs/dbraw/zinc/26/43/90/204264390.db2.gz AGAUWNCOVNCAJK-GOSISDBHSA-N 1 1 393.531 3.471 10 0 GGAEMO COc1ccc(-c2nn(-c3ccccc3)cc2C[N@H+](CC(N)=O)C(C)C)cc1 ZINC000008532877 204279207 /nfs/dbraw/zinc/27/92/07/204279207.db2.gz SRXKTPOKZTXEEH-UHFFFAOYSA-N 1 1 378.476 3.244 10 0 GGAEMO COc1ccc(-c2nn(-c3ccccc3)cc2C[N@@H+](CC(N)=O)C(C)C)cc1 ZINC000008532877 204279212 /nfs/dbraw/zinc/27/92/12/204279212.db2.gz SRXKTPOKZTXEEH-UHFFFAOYSA-N 1 1 378.476 3.244 10 0 GGAEMO CCCCC(=O)N1CCN(c2nc(Nc3ccc(OC)cc3)cc(C)[nH+]2)CC1 ZINC000009573248 204315874 /nfs/dbraw/zinc/31/58/74/204315874.db2.gz WCLVFEZALKJFAO-UHFFFAOYSA-N 1 1 383.496 3.376 10 0 GGAEMO COc1ccc(OC)c([C@@H]2CCC[N@@H+]2CC(=O)N2CCc3sccc3C2)c1 ZINC000009975637 204328307 /nfs/dbraw/zinc/32/83/07/204328307.db2.gz BFDHJGOQLNRZCR-SFHVURJKSA-N 1 1 386.517 3.487 10 0 GGAEMO COc1ccc(OC)c([C@@H]2CCC[N@H+]2CC(=O)N2CCc3sccc3C2)c1 ZINC000009975637 204328312 /nfs/dbraw/zinc/32/83/12/204328312.db2.gz BFDHJGOQLNRZCR-SFHVURJKSA-N 1 1 386.517 3.487 10 0 GGAEMO CCCn1nc(C(=O)NCCC[N@@H+](C)Cc2ccccc2)c2ccccc2c1=O ZINC000009981975 204329395 /nfs/dbraw/zinc/32/93/95/204329395.db2.gz WIYIKMOEBUUYJI-UHFFFAOYSA-N 1 1 392.503 3.058 10 0 GGAEMO Cc1nc(C(=O)NC[C@H](c2ccco2)[NH+]2CCCC2)nn1-c1ccc(Cl)cc1 ZINC000010218162 204331601 /nfs/dbraw/zinc/33/16/01/204331601.db2.gz JQVXRDJFCJEGKI-QGZVFWFLSA-N 1 1 399.882 3.389 10 0 GGAEMO C[C@@H](C(=O)NC(=O)NC1CC1)[N@H+](C)Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000011432576 204346916 /nfs/dbraw/zinc/34/69/16/204346916.db2.gz HRGUIYWUZICJBF-LBPRGKRZSA-N 1 1 375.856 3.409 10 0 GGAEMO C[C@@H](C(=O)NC(=O)NC1CC1)[N@@H+](C)Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000011432576 204346917 /nfs/dbraw/zinc/34/69/17/204346917.db2.gz HRGUIYWUZICJBF-LBPRGKRZSA-N 1 1 375.856 3.409 10 0 GGAEMO O=C(C[C@@H]1C(=O)NCC[N@@H+]1CC1CCCCC1)N1CC=C(c2ccccc2)CC1 ZINC000011842923 204357732 /nfs/dbraw/zinc/35/77/32/204357732.db2.gz DJXRRCHXRBYHEX-JOCHJYFZSA-N 1 1 395.547 3.073 10 0 GGAEMO COc1cccc(C[N@H+]2CCC[C@]3(CCN(Cc4cnc(C)nc4)C3)C2)c1OC ZINC000011874510 204359244 /nfs/dbraw/zinc/35/92/44/204359244.db2.gz IOHLCGYPFYAWRE-QHCPKHFHSA-N 1 1 396.535 3.290 10 0 GGAEMO COc1cccc(CN2CCC[C@]3(CC[N@H+](Cc4cnc(C)nc4)C3)C2)c1OC ZINC000011874510 204359248 /nfs/dbraw/zinc/35/92/48/204359248.db2.gz IOHLCGYPFYAWRE-QHCPKHFHSA-N 1 1 396.535 3.290 10 0 GGAEMO COc1cccc(CN2CCC[C@]3(CC[N@@H+](Cc4cnc(C)nc4)C3)C2)c1OC ZINC000011874510 204359252 /nfs/dbraw/zinc/35/92/52/204359252.db2.gz IOHLCGYPFYAWRE-QHCPKHFHSA-N 1 1 396.535 3.290 10 0 GGAEMO CCc1ncc(C[N@H+]2CCC[C@@H](C(=O)Nc3ccc(-c4cc[nH]n4)cc3)C2)cn1 ZINC000011935889 204363186 /nfs/dbraw/zinc/36/31/86/204363186.db2.gz YQGRLICJADLUIV-GOSISDBHSA-N 1 1 390.491 3.280 10 0 GGAEMO c1ccc(CN2CCC([N@H+]3CCC[C@H](Nc4ccc5c(c4)OCO5)C3)CC2)nc1 ZINC000011938555 204363873 /nfs/dbraw/zinc/36/38/73/204363873.db2.gz XWQFKYJEYHPBLK-FQEVSTJZSA-N 1 1 394.519 3.351 10 0 GGAEMO Cn1nccc1C(=O)N1CCC([C@H]2CC[N@@H+](Cc3ccc(Cl)cc3)C2)CC1 ZINC000012028702 204368000 /nfs/dbraw/zinc/36/80/00/204368000.db2.gz JQUOMFGNWIBRGF-SFHVURJKSA-N 1 1 386.927 3.448 10 0 GGAEMO CCCCNC(=O)N1CCC[C@H]([N@@H+](C)CCc2ccc(OC)c(OC)c2)C1 ZINC000012076530 204370421 /nfs/dbraw/zinc/37/04/21/204370421.db2.gz KCAGIGFXMUOQKZ-SFHVURJKSA-N 1 1 377.529 3.152 10 0 GGAEMO CN(Cc1cccc(OC[C@H](O)C[NH+]2CCCCCC2)c1)Cc1ccccn1 ZINC000012306574 204393598 /nfs/dbraw/zinc/39/35/98/204393598.db2.gz DPTMRROKHUGGLB-JOCHJYFZSA-N 1 1 383.536 3.329 10 0 GGAEMO CN(Cc1cccc(OC[C@@H](O)C[NH+]2CCCCCC2)c1)Cc1ccccn1 ZINC000012306572 204393869 /nfs/dbraw/zinc/39/38/69/204393869.db2.gz DPTMRROKHUGGLB-QFIPXVFZSA-N 1 1 383.536 3.329 10 0 GGAEMO CN(Cc1ccno1)Cc1ccc(OC[C@@H](O)C[N@@H+](C)Cc2ccccc2)cc1 ZINC000012313944 204395616 /nfs/dbraw/zinc/39/56/16/204395616.db2.gz SBNQLYAQDHGTJQ-NRFANRHFSA-N 1 1 395.503 3.178 10 0 GGAEMO CC(C)(C)S(=O)(=O)c1ccc(NC2CC[NH+](Cc3ccccc3)CC2)nn1 ZINC000016843960 204602726 /nfs/dbraw/zinc/60/27/26/204602726.db2.gz XYABGDMPDWMNGD-UHFFFAOYSA-N 1 1 388.537 3.125 10 0 GGAEMO COc1ccc(-c2nc3ccccc3c(NCCC[NH+]3CCOCC3)n2)cc1 ZINC000021641406 204760454 /nfs/dbraw/zinc/76/04/54/204760454.db2.gz XJRJKQPGULMORL-UHFFFAOYSA-N 1 1 378.476 3.440 10 0 GGAEMO C[C@H]1CN(CC(=O)N2CC[NH+](Cc3ccccc3)CC2)c2ccccc2S1 ZINC000033059154 204942158 /nfs/dbraw/zinc/94/21/58/204942158.db2.gz ACKYGEPQLSDMMM-SFHVURJKSA-N 1 1 381.545 3.332 10 0 GGAEMO CCOC(=O)C1=C(C[NH+]2CCC(C)CC2)N(C)C(=O)N[C@H]1c1ccccc1C ZINC000035991337 204999723 /nfs/dbraw/zinc/99/97/23/204999723.db2.gz MNAZIZUVKIWGFP-FQEVSTJZSA-N 1 1 385.508 3.240 10 0 GGAEMO CCOC(=O)C1=C(C[N@@H+](C)C2CCCCC2)N(C)C(=O)N[C@@H]1c1ccccc1 ZINC000035991608 205000131 /nfs/dbraw/zinc/00/01/31/205000131.db2.gz VJPFDWNJMBXXKL-HXUWFJFHSA-N 1 1 385.508 3.464 10 0 GGAEMO CCOC(=O)C1=C(C[NH+]2CCC(C)CC2)N(C)C(=O)N[C@H]1c1ccc(F)cc1 ZINC000035991571 205000164 /nfs/dbraw/zinc/00/01/64/205000164.db2.gz IRXJOZBELNOQRJ-IBGZPJMESA-N 1 1 389.471 3.071 10 0 GGAEMO COCCC[N@H+](Cc1ccc(F)cc1F)C[C@H](O)COCc1ccccc1 ZINC000036099705 205004756 /nfs/dbraw/zinc/00/47/56/205004756.db2.gz HDJVYNBBLVPTMZ-FQEVSTJZSA-N 1 1 379.447 3.381 10 0 GGAEMO COc1ccc(C[N@@H+](C[C@@H](O)COc2ccccc2C)C[C@@H]2CCCO2)cc1 ZINC000036095276 205004842 /nfs/dbraw/zinc/00/48/42/205004842.db2.gz RJDQZZHLYOTZFW-IRLDBZIGSA-N 1 1 385.504 3.425 10 0 GGAEMO COc1ccc(C[N@@H+](CC(C)C)C[C@@H](O)COCc2ccco2)cc1OC ZINC000036095619 205005010 /nfs/dbraw/zinc/00/50/10/205005010.db2.gz BCMSZVYYFNKDMA-GOSISDBHSA-N 1 1 377.481 3.333 10 0 GGAEMO O[C@@H](COc1ccccc1)C[N@@H+](Cc1ccc(F)cc1F)C[C@@H]1CCCO1 ZINC000036099753 205005281 /nfs/dbraw/zinc/00/52/81/205005281.db2.gz LRXILNWEUBHTSB-QUCCMNQESA-N 1 1 377.431 3.386 10 0 GGAEMO O[C@@H](COc1ccccc1)C[N@H+](Cc1ccc(F)cc1F)C[C@@H]1CCCO1 ZINC000036099753 205005283 /nfs/dbraw/zinc/00/52/83/205005283.db2.gz LRXILNWEUBHTSB-QUCCMNQESA-N 1 1 377.431 3.386 10 0 GGAEMO COc1ccc(OC[C@@H](O)C[N@@H+](Cc2ccc(OC)c(OC)c2)C2CC2)cc1 ZINC000036095842 205005365 /nfs/dbraw/zinc/00/53/65/205005365.db2.gz RMFSWBMNTHIEPQ-SFHVURJKSA-N 1 1 387.476 3.117 10 0 GGAEMO COc1ccc(C[N@@H+](Cc2ccco2)C[C@@H](O)COCC(C)C)cc1OC ZINC000036095735 205005378 /nfs/dbraw/zinc/00/53/78/205005378.db2.gz QQCUVLIQSIKIHT-GOSISDBHSA-N 1 1 377.481 3.333 10 0 GGAEMO COc1ccc(C[N@H+](Cc2ccco2)C[C@@H](O)COCC(C)C)cc1OC ZINC000036095735 205005381 /nfs/dbraw/zinc/00/53/81/205005381.db2.gz QQCUVLIQSIKIHT-GOSISDBHSA-N 1 1 377.481 3.333 10 0 GGAEMO O[C@H](COc1ccccc1)C[N@@H+](Cc1ccc(F)cc1F)C[C@@H]1CCCO1 ZINC000036099755 205005729 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CSc1ncc([C@@H]2C[C@H]3CN(CCc4ccccc4)C(=O)[C@]34CCC[N@@H+]24)cn1 ZINC000055072283 205141505 /nfs/dbraw/zinc/14/15/05/205141505.db2.gz OBJMWGWEBUOSRG-IPJJNNNSSA-N 1 1 394.544 3.179 10 0 GGAEMO COCC[N@H+]1CC[C@@H](CNC(=O)c2ccccc2NCc2sccc2C)C1 ZINC000055166429 205142748 /nfs/dbraw/zinc/14/27/48/205142748.db2.gz KWBGBWDDZBXOKL-KRWDZBQOSA-N 1 1 387.549 3.367 10 0 GGAEMO COc1ccc(N[C@H]2CCC[N@@H+](Cc3cnc(N(C)C)s3)C2)cc1OC ZINC000055284154 205148011 /nfs/dbraw/zinc/14/80/11/205148011.db2.gz UELSTDUSEUNGLW-HNNXBMFYSA-N 1 1 376.526 3.303 10 0 GGAEMO C[NH+](C)[C@@H](CNC(=S)Nc1cccc(Br)c1)c1cccnc1 ZINC000057011193 205153175 /nfs/dbraw/zinc/15/31/75/205153175.db2.gz YBMTXWOXQGPTCP-HNNXBMFYSA-N 1 1 379.327 3.433 10 0 GGAEMO O=C(NCc1cccc(C[NH+]2CCOCC2)c1)N[C@@H]1CCCc2ccccc21 ZINC000057451317 205156460 /nfs/dbraw/zinc/15/64/60/205156460.db2.gz BNMUBWFDCUCTGH-JOCHJYFZSA-N 1 1 379.504 3.396 10 0 GGAEMO COc1ccc(N[C@@H](C)C(=O)N2CC[NH+](Cc3ccccc3)CC2)cc1Cl ZINC000057406377 205157284 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398.507 3.283 10 0 GGAEMO CC(C)C[N@H+]1CCCC[C@H]1C(=O)NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1 ZINC000058431899 205175086 /nfs/dbraw/zinc/17/50/86/205175086.db2.gz UIBOGNJVVSJTRI-JXFKEZNVSA-N 1 1 379.495 3.418 10 0 GGAEMO Cc1[nH+]ccn1CCCNC(=O)c1cc2cc(Br)ccc2n1C ZINC000059443535 205178023 /nfs/dbraw/zinc/17/80/23/205178023.db2.gz RAXQOPLDKFNBGM-UHFFFAOYSA-N 1 1 375.270 3.266 10 0 GGAEMO O=C(C[NH+]1CCCC1)N1N=C(c2ccccc2)C[C@@H]1c1ccc2nccnc2c1 ZINC000060208324 205179620 /nfs/dbraw/zinc/17/96/20/205179620.db2.gz PHEOZMGQHYESGS-JOCHJYFZSA-N 1 1 385.471 3.403 10 0 GGAEMO O=C(C[NH+]1CCCC1)N1N=C(c2ccccc2)C[C@H]1c1ccc2nccnc2c1 ZINC000060208323 205180346 /nfs/dbraw/zinc/18/03/46/205180346.db2.gz PHEOZMGQHYESGS-QFIPXVFZSA-N 1 1 385.471 3.403 10 0 GGAEMO CC[NH+]1CCN(C(=O)c2ccc(-c3ccc4c(c3)CCN4C(C)=O)cc2)CC1 ZINC000065026976 205207588 /nfs/dbraw/zinc/20/75/88/205207588.db2.gz DJPLHVGDKQTZCX-UHFFFAOYSA-N 1 1 377.488 3.040 10 0 GGAEMO COc1ccc(-c2noc(C3CC[NH+](CC(=O)NC4CCCCC4)CC3)n2)cc1 ZINC000065184239 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COCC[N@H+]1CCN(C(=O)Nc2c(C)cc(Br)cc2C)C[C@H]1C ZINC000117444715 564227284 /nfs/dbraw/zinc/22/72/84/564227284.db2.gz HKDCIODLHGIFQN-CQSZACIVSA-N 1 1 384.318 3.250 10 0 GGAEMO CC[C@@H]1CN(C(=O)Nc2ccc(C)cc2Br)CC[N@H+]1CCOC ZINC000117436053 564227616 /nfs/dbraw/zinc/22/76/16/564227616.db2.gz IRFABFBFIJKRFQ-CQSZACIVSA-N 1 1 384.318 3.332 10 0 GGAEMO CC[N@H+]1CCC[C@H](NC(=O)c2cc(-c3ccc(Br)cc3)n[nH]2)C1 ZINC000117705541 564230240 /nfs/dbraw/zinc/23/02/40/564230240.db2.gz WPQYBYPIRASNHN-AWEZNQCLSA-N 1 1 377.286 3.053 10 0 GGAEMO CN(CCc1nccs1)C(=O)N[C@@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000119375527 564268264 /nfs/dbraw/zinc/26/82/64/564268264.db2.gz LOQIMMFQSDGIKG-WBVHZDCISA-N 1 1 378.929 3.426 10 0 GGAEMO CN(CCc1nccs1)C(=O)N[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000119375527 564268265 /nfs/dbraw/zinc/26/82/65/564268265.db2.gz LOQIMMFQSDGIKG-WBVHZDCISA-N 1 1 378.929 3.426 10 0 GGAEMO O=C1[C@@H]([NH2+]Cc2cc(C(F)(F)F)ccc2Cl)CCN1C1CCOCC1 ZINC000119455039 564272400 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CC[N@H+]1CCC[C@@H]1CNC(=O)c1nnc(Cc2ccc(Cl)cc2Cl)o1 ZINC000020851779 564307689 /nfs/dbraw/zinc/30/76/89/564307689.db2.gz QWLOCGKNHDCRRE-CYBMUJFWSA-N 1 1 383.279 3.181 10 0 GGAEMO C[C@@H](O)C[N@H+]1CCN(C(=O)CCCc2cc(Cl)sc2Cl)C[C@@H]1C ZINC000120678636 564332505 /nfs/dbraw/zinc/33/25/05/564332505.db2.gz XMAFGBWJJPYREM-NWDGAFQWSA-N 1 1 379.353 3.291 10 0 GGAEMO C[C@H](O)[C@H]1CCC[N@@H+](CCCOc2cccc(I)c2)C1 ZINC000120837810 564339978 /nfs/dbraw/zinc/33/99/78/564339978.db2.gz FDFJVEAYQIUZOA-KBPBESRZSA-N 1 1 389.277 3.153 10 0 GGAEMO CCOCC[N@@H+]1CCN(Cc2cc(Br)c(OC)s2)C[C@@H]1C ZINC000120872660 564340864 /nfs/dbraw/zinc/34/08/64/564340864.db2.gz HENKCYVZVXJKRO-LBPRGKRZSA-N 1 1 377.348 3.062 10 0 GGAEMO CCOCC[N@H+]1CCN(Cc2cc(Br)c(OC)s2)C[C@@H]1C ZINC000120872660 564340869 /nfs/dbraw/zinc/34/08/69/564340869.db2.gz HENKCYVZVXJKRO-LBPRGKRZSA-N 1 1 377.348 3.062 10 0 GGAEMO FC(F)(F)c1cc(Br)cc(CN2CC[C@H]([NH+]3CCOCC3)C2)c1 ZINC000121042999 564350215 /nfs/dbraw/zinc/35/02/15/564350215.db2.gz OKUVKKIGCZUMHI-HNNXBMFYSA-N 1 1 393.247 3.374 10 0 GGAEMO C[N@H+](CCOc1cccc(Cl)c1)CC(=O)N1CCC[C@H](C(F)(F)F)C1 ZINC000121134030 564354975 /nfs/dbraw/zinc/35/49/75/564354975.db2.gz WDLQYMSNYOQYNH-ZDUSSCGKSA-N 1 1 378.822 3.452 10 0 GGAEMO C[N@@H+](CCOc1cccc(Cl)c1)CC(=O)N1CCC[C@H](C(F)(F)F)C1 ZINC000121134030 564354977 /nfs/dbraw/zinc/35/49/77/564354977.db2.gz WDLQYMSNYOQYNH-ZDUSSCGKSA-N 1 1 378.822 3.452 10 0 GGAEMO C[N@H+](CCOc1cccc(Cl)c1)CC(=O)N1CCC[C@@H](C(F)(F)F)C1 ZINC000121134185 564355218 /nfs/dbraw/zinc/35/52/18/564355218.db2.gz WDLQYMSNYOQYNH-CYBMUJFWSA-N 1 1 378.822 3.452 10 0 GGAEMO C[N@@H+](CCOc1cccc(Cl)c1)CC(=O)N1CCC[C@@H](C(F)(F)F)C1 ZINC000121134185 564355221 /nfs/dbraw/zinc/35/52/21/564355221.db2.gz WDLQYMSNYOQYNH-CYBMUJFWSA-N 1 1 378.822 3.452 10 0 GGAEMO CC(C)C[N@H+]1CCO[C@@H](CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000028013369 564358787 /nfs/dbraw/zinc/35/87/87/564358787.db2.gz VYSGYBKWBMMFSF-HIFRSBDPSA-N 1 1 389.323 3.234 10 0 GGAEMO CCOCC[NH+]1CCN(C(=O)C[C@@H](C)c2ccc(Br)cc2)CC1 ZINC000121202098 564359014 /nfs/dbraw/zinc/35/90/14/564359014.db2.gz LORUPYXESSURQD-OAHLLOKOSA-N 1 1 383.330 3.123 10 0 GGAEMO COc1ccc(OC)c([C@H](C)[NH2+]CC(=O)Nc2ccc(Br)cn2)c1 ZINC000121515386 564372710 /nfs/dbraw/zinc/37/27/10/564372710.db2.gz UUKJLRURXZNTPW-NSHDSACASA-N 1 1 394.269 3.151 10 0 GGAEMO C[C@@H]([NH2+]Cc1cc(F)ccc1Br)c1ccc(S(N)(=O)=O)cc1 ZINC000121570688 564375547 /nfs/dbraw/zinc/37/55/47/564375547.db2.gz PJCRSVIXEVOASK-SNVBAGLBSA-N 1 1 387.274 3.086 10 0 GGAEMO CC[N@H+]1CCC[C@@H](NC(=O)C(=O)Nc2ccc(Br)cc2C(C)C)C1 ZINC000121580503 564375867 /nfs/dbraw/zinc/37/58/67/564375867.db2.gz HMEGRFANIWGXLE-CQSZACIVSA-N 1 1 396.329 3.112 10 0 GGAEMO C[C@H](C[N@H+]1CCCN(Cc2cnn(C)c2)CC1)c1cccc(Br)c1 ZINC000121594946 564376776 /nfs/dbraw/zinc/37/67/76/564376776.db2.gz CAFNRNPIEUKNHE-MRXNPFEDSA-N 1 1 391.357 3.494 10 0 GGAEMO C[C@H](CN1CCC[N@H+](Cc2cnn(C)c2)CC1)c1cccc(Br)c1 ZINC000121594946 564376781 /nfs/dbraw/zinc/37/67/81/564376781.db2.gz CAFNRNPIEUKNHE-MRXNPFEDSA-N 1 1 391.357 3.494 10 0 GGAEMO C[C@H](CN1CCC[N@@H+](Cc2cnn(C)c2)CC1)c1cccc(Br)c1 ZINC000121594946 564376788 /nfs/dbraw/zinc/37/67/88/564376788.db2.gz CAFNRNPIEUKNHE-MRXNPFEDSA-N 1 1 391.357 3.494 10 0 GGAEMO C[C@@H](CC(=O)N(C)CCC[NH+]1CCN(C)CC1)c1ccc(Br)cc1 ZINC000121679707 564381263 /nfs/dbraw/zinc/38/12/63/564381263.db2.gz RGGZJEOSJFNQFR-INIZCTEOSA-N 1 1 396.373 3.039 10 0 GGAEMO CCCOc1ccc(Br)cc1C[NH2+]CC(=O)NCc1ccco1 ZINC000030642111 564383135 /nfs/dbraw/zinc/38/31/35/564383135.db2.gz JYQGKDNYXIFREI-UHFFFAOYSA-N 1 1 381.270 3.237 10 0 GGAEMO O=C(C[NH2+]Cc1cc(Br)ccc1OC(F)F)NCc1ccco1 ZINC000030642167 564383231 /nfs/dbraw/zinc/38/32/31/564383231.db2.gz SWKIHCMAIMWNTR-UHFFFAOYSA-N 1 1 389.196 3.050 10 0 GGAEMO Cn1cc[nH+]c1CC1CCN(Cc2cnc3ccc(Br)cn23)CC1 ZINC000121758692 564385680 /nfs/dbraw/zinc/38/56/80/564385680.db2.gz DKXRSKOKONBOBX-UHFFFAOYSA-N 1 1 388.313 3.285 10 0 GGAEMO C[C@@H]1CCC[N@@H+](CCCNC(=O)COc2ccc(F)cc2Br)C1 ZINC000032931221 564407537 /nfs/dbraw/zinc/40/75/37/564407537.db2.gz CDFVSUNCKQMLFB-CYBMUJFWSA-N 1 1 387.293 3.205 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(OC)c(Br)c(OC)c2)[C@H](C)C1 ZINC000122344569 564409520 /nfs/dbraw/zinc/40/95/20/564409520.db2.gz QMKFTFYCNXLWQG-TZMCWYRMSA-N 1 1 399.329 3.269 10 0 GGAEMO OC[C@@H](Nc1cc[nH+]c(N2CCCCC2)n1)c1cccc(Br)c1 ZINC000545346984 564417616 /nfs/dbraw/zinc/41/76/16/564417616.db2.gz PVQJCMQWXNCAKJ-OAHLLOKOSA-N 1 1 377.286 3.375 10 0 GGAEMO C[C@H](CC(=O)N1C[C@H]([NH+]2CCOCC2)[C@@H](C)C1)c1ccc(Br)cc1 ZINC000122755215 564426067 /nfs/dbraw/zinc/42/60/67/564426067.db2.gz SHCKSIGLWOWLIL-VKJFTORMSA-N 1 1 395.341 3.122 10 0 GGAEMO COc1ccc(CCC(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1Br ZINC000122792325 564428017 /nfs/dbraw/zinc/42/80/17/564428017.db2.gz DBOXILBSCXYPAQ-UKRRQHHQSA-N 1 1 383.330 3.331 10 0 GGAEMO C[NH+]1CCN([C@@H]2CCCCN(Cc3csc(-c4cccs4)n3)C2)CC1 ZINC000122817283 564428614 /nfs/dbraw/zinc/42/86/14/564428614.db2.gz UISPBBRWMDFZRV-QGZVFWFLSA-N 1 1 376.595 3.474 10 0 GGAEMO Cn1cc[nH+]c1CC1CCN(S(=O)(=O)c2ccc(C(C)(C)C)s2)CC1 ZINC000122995062 564434092 /nfs/dbraw/zinc/43/40/92/564434092.db2.gz JFWFGTJVWDJERN-UHFFFAOYSA-N 1 1 381.567 3.423 10 0 GGAEMO C[C@@H]1C[C@H](N(C)C(=O)c2cnn(-c3cccc(Br)c3)c2)CC[N@H+]1C ZINC000122972554 564434146 /nfs/dbraw/zinc/43/41/46/564434146.db2.gz SHXSRTMPHAQZGU-CZUORRHYSA-N 1 1 391.313 3.190 10 0 GGAEMO COc1cccc([C@@H](C)[N@H+](C)CC(=O)Nc2ccc(Br)cn2)c1 ZINC000123013227 564435165 /nfs/dbraw/zinc/43/51/65/564435165.db2.gz JABLAMNGMANLSP-GFCCVEGCSA-N 1 1 378.270 3.484 10 0 GGAEMO COc1cccc([C@@H](C)[N@@H+](C)CC(=O)Nc2ccc(Br)cn2)c1 ZINC000123013227 564435167 /nfs/dbraw/zinc/43/51/67/564435167.db2.gz JABLAMNGMANLSP-GFCCVEGCSA-N 1 1 378.270 3.484 10 0 GGAEMO CC(C)NC(=O)C[NH2+][C@@H](C)c1ccc(Br)cc1Br ZINC000041641960 564435621 /nfs/dbraw/zinc/43/56/21/564435621.db2.gz XCOGHTIWTHMIAE-VIFPVBQESA-N 1 1 378.108 3.387 10 0 GGAEMO CCCNC(=O)C[NH2+][C@H](C)c1ccc(Br)cc1Br ZINC000041641958 564436060 /nfs/dbraw/zinc/43/60/60/564436060.db2.gz XDPQLLIXEHSCOP-SECBINFHSA-N 1 1 378.108 3.388 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)Cc2nc(-c3cc(Br)cs3)no2)CC[N@H+]1C ZINC000123389164 564446874 /nfs/dbraw/zinc/44/68/74/564446874.db2.gz SAQIQJVALIGAMQ-PWSUYJOCSA-N 1 1 385.331 3.475 10 0 GGAEMO COc1ccsc1S(=O)(=O)N[C@@H](C)c1ccc(-n2cc[nH+]c2C)cc1 ZINC000123404291 564447586 /nfs/dbraw/zinc/44/75/86/564447586.db2.gz FDUAXPCEBTZUQZ-LBPRGKRZSA-N 1 1 377.491 3.290 10 0 GGAEMO C[C@@H]1C[C@H](N(C)CC(=O)Nc2ccc(Br)cc2Cl)CC[N@H+]1C ZINC000123481214 564449461 /nfs/dbraw/zinc/44/94/61/564449461.db2.gz ZBVWWEMZTXYSHR-DGCLKSJQSA-N 1 1 388.737 3.456 10 0 GGAEMO C[C@H]1C[C@H](N(C)CC(=O)Nc2ccc(Br)cc2Cl)CC[N@H+]1C ZINC000123481442 564449884 /nfs/dbraw/zinc/44/98/84/564449884.db2.gz ZBVWWEMZTXYSHR-WCQYABFASA-N 1 1 388.737 3.456 10 0 GGAEMO COc1cc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc(OC)c1Br ZINC000123603126 564454941 /nfs/dbraw/zinc/45/49/41/564454941.db2.gz JZZWPAACFYCSMW-WCQYABFASA-N 1 1 385.302 3.021 10 0 GGAEMO 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COc1ccccc1S(=O)(=O)CCC[N@@H+](CCc1nccs1)C(C)C ZINC000184270434 565124149 /nfs/dbraw/zinc/12/41/49/565124149.db2.gz CZBGHVWPEQBXCJ-UHFFFAOYSA-N 1 1 382.551 3.269 10 0 GGAEMO COCC[N@@H+]1CCN(C(=O)Nc2ccc(Cl)cc2OC(F)F)C[C@H]1C ZINC000184397153 565133715 /nfs/dbraw/zinc/13/37/15/565133715.db2.gz WSCFZYNZYGSFHT-LLVKDONJSA-N 1 1 377.819 3.126 10 0 GGAEMO COCC[N@H+]1CCN(C(=O)Nc2ccc(Cl)cc2OC(F)F)C[C@H]1C ZINC000184397153 565133721 /nfs/dbraw/zinc/13/37/21/565133721.db2.gz WSCFZYNZYGSFHT-LLVKDONJSA-N 1 1 377.819 3.126 10 0 GGAEMO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]CC(=O)Nc1ccc(Br)cn1 ZINC000157555144 565135590 /nfs/dbraw/zinc/13/55/90/565135590.db2.gz RTIDNMKWCLLSCS-LLVKDONJSA-N 1 1 394.317 3.393 10 0 GGAEMO CN(CCC[NH+]1CCN(C)CC1)C(=O)N[C@@H]1CCCc2sc(Cl)cc21 ZINC000292834160 565137206 /nfs/dbraw/zinc/13/72/06/565137206.db2.gz BQRMCHXVBWAQSJ-OAHLLOKOSA-N 1 1 384.977 3.058 10 0 GGAEMO O[C@@H](COC1CCOCC1)C[N@H+]1CCC[C@H]1Cc1ccc(Br)cc1 ZINC000370346168 565139192 /nfs/dbraw/zinc/13/91/92/565139192.db2.gz AJGXXLIORNZOEB-ZWKOTPCHSA-N 1 1 398.341 3.013 10 0 GGAEMO CCOC(=O)c1csc(C[NH2+][C@@]2(Cc3ccc(Cl)cc3)CCOC2)n1 ZINC000292928037 565142125 /nfs/dbraw/zinc/14/21/25/565142125.db2.gz MHNLIPDQUJSICL-GOSISDBHSA-N 1 1 380.897 3.465 10 0 GGAEMO COC(=O)CC[N@H+](Cc1cccc(Br)c1)Cc1cc(C)ncn1 ZINC000293007014 565146198 /nfs/dbraw/zinc/14/61/98/565146198.db2.gz ZPBPNCKGRGKIGT-UHFFFAOYSA-N 1 1 378.270 3.113 10 0 GGAEMO COC(=O)CC[N@@H+](Cc1cccc(Br)c1)Cc1cc(C)ncn1 ZINC000293007014 565146202 /nfs/dbraw/zinc/14/62/02/565146202.db2.gz ZPBPNCKGRGKIGT-UHFFFAOYSA-N 1 1 378.270 3.113 10 0 GGAEMO C[C@H]1CN(C(=O)Cc2csc3ccc(Cl)cc23)C[C@H]1[NH+]1CCOCC1 ZINC000157860703 565146368 /nfs/dbraw/zinc/14/63/68/565146368.db2.gz CCTHARSJGKISLD-SUMWQHHRSA-N 1 1 378.925 3.276 10 0 GGAEMO C[C@H]1CN(C(=O)Cc2csc3ccc(Cl)cc23)C[C@@H]1[NH+]1CCOCC1 ZINC000157860454 565146615 /nfs/dbraw/zinc/14/66/15/565146615.db2.gz CCTHARSJGKISLD-GUYCJALGSA-N 1 1 378.925 3.276 10 0 GGAEMO C[C@@H]1CN(C(=O)Cc2csc3ccc(Cl)cc23)C[C@H]1[NH+]1CCOCC1 ZINC000157860566 565146706 /nfs/dbraw/zinc/14/67/06/565146706.db2.gz CCTHARSJGKISLD-CXAGYDPISA-N 1 1 378.925 3.276 10 0 GGAEMO CC[N@H+]1CCC[C@@H](NC(=O)NCc2cc3cc(Br)ccc3[nH]2)C1 ZINC000184738638 565155258 /nfs/dbraw/zinc/15/52/58/565155258.db2.gz ZHBBBRNEWHTKOX-CQSZACIVSA-N 1 1 379.302 3.214 10 0 GGAEMO OCC[N@H+](Cc1ccc(Cl)c(Cl)c1)C[C@@H](O)COCc1ccccc1 ZINC000158131182 565157668 /nfs/dbraw/zinc/15/76/68/565157668.db2.gz WFAHGOFDPSKBQE-QGZVFWFLSA-N 1 1 384.303 3.365 10 0 GGAEMO C[C@H](c1cccc(S(N)(=O)=O)c1)[N@@H+](C)Cc1cccc(Br)c1 ZINC000158266059 565162357 /nfs/dbraw/zinc/16/23/57/565162357.db2.gz NDJWNVQKWUCJOF-GFCCVEGCSA-N 1 1 383.311 3.290 10 0 GGAEMO CC(C)C(=O)NC[C@@H]1CCC[N@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000184962289 565167349 /nfs/dbraw/zinc/16/73/49/565167349.db2.gz YOUNNOKDBPPWAW-ZDUSSCGKSA-N 1 1 393.329 3.310 10 0 GGAEMO CC(C)C(=O)NC[C@@H]1CCC[N@@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000184962289 565167352 /nfs/dbraw/zinc/16/73/52/565167352.db2.gz YOUNNOKDBPPWAW-ZDUSSCGKSA-N 1 1 393.329 3.310 10 0 GGAEMO O=C(NCC1CC1)[C@H]1CCC[N@@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000184948058 565167762 /nfs/dbraw/zinc/16/77/62/565167762.db2.gz CXENTSSZTDVLJP-ZDUSSCGKSA-N 1 1 391.313 3.064 10 0 GGAEMO O=C(NCC1CC1)[C@H]1CCC[N@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000184948058 565167768 /nfs/dbraw/zinc/16/77/68/565167768.db2.gz CXENTSSZTDVLJP-ZDUSSCGKSA-N 1 1 391.313 3.064 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)C(=O)Cc2c[nH]c3cc(Br)ccc23)CC[N@H+]1C ZINC000158450189 565170202 /nfs/dbraw/zinc/17/02/02/565170202.db2.gz ZDOQPQKSGQWRIG-DOMZBBRYSA-N 1 1 378.314 3.414 10 0 GGAEMO Cc1cnn([C@@H]2CC[N@@H+](C[C@](C)(O)c3ccc(Br)cc3F)C2)c1 ZINC000293533492 565173782 /nfs/dbraw/zinc/17/37/82/565173782.db2.gz JPHXTEPBZBHEJR-PBHICJAKSA-N 1 1 382.277 3.248 10 0 GGAEMO C[C@@H](CCN1CC[NH+](C)CC1)NC(=O)N[C@@H]1CCCc2sc(Cl)cc21 ZINC000293596966 565175792 /nfs/dbraw/zinc/17/57/92/565175792.db2.gz ZLZRPRDKQMSRKK-DZGCQCFKSA-N 1 1 384.977 3.104 10 0 GGAEMO C[N@@H+]1CC[C@H](NC(=O)c2ccncc2Br)[C@H]1c1ccc(F)cc1 ZINC000371075775 565176076 /nfs/dbraw/zinc/17/60/76/565176076.db2.gz NOMXBSZSZUIFOD-JKSUJKDBSA-N 1 1 378.245 3.158 10 0 GGAEMO C[N@H+]1CC[C@H](NC(=O)c2ccncc2Br)[C@H]1c1ccc(F)cc1 ZINC000371075775 565176080 /nfs/dbraw/zinc/17/60/80/565176080.db2.gz NOMXBSZSZUIFOD-JKSUJKDBSA-N 1 1 378.245 3.158 10 0 GGAEMO C[C@@H](CC(=O)c1cccc(Br)c1)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000371301339 565185894 /nfs/dbraw/zinc/18/58/94/565185894.db2.gz FDQXBWOMLKWPRC-SMDDNHRTSA-N 1 1 390.281 3.055 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)c3sc(-c4cccs4)nc3C)[C@H]2C1 ZINC000293825702 565186319 /nfs/dbraw/zinc/18/63/19/565186319.db2.gz GQZSHVCMXXXRDH-UONOGXRCSA-N 1 1 377.535 3.115 10 0 GGAEMO O=C(CCCOc1cccc(Br)c1)N[C@H]1CCc2nc[nH]c2C1 ZINC000371307155 565186340 /nfs/dbraw/zinc/18/63/40/565186340.db2.gz BGCRAKVCUSAPJN-ZDUSSCGKSA-N 1 1 378.270 3.005 10 0 GGAEMO C[C@@](O)(C[N@H+]1CCC[C@H](c2ncc[nH]2)C1)c1ccc(Br)cc1F ZINC000293836415 565186860 /nfs/dbraw/zinc/18/68/60/565186860.db2.gz QECSLLIXUWWOFC-YVEFUNNKSA-N 1 1 382.277 3.398 10 0 GGAEMO CCc1[nH+]ccn1[C@@H]1CCCN(S(=O)(=O)c2cnc(Cl)c(Cl)c2)C1 ZINC000158932548 565187364 /nfs/dbraw/zinc/18/73/64/565187364.db2.gz SHYGSWGYLYCCDS-LLVKDONJSA-N 1 1 389.308 3.173 10 0 GGAEMO CN1C[C@@H]([NH2+][C@H](c2ccc(Br)o2)c2ccc(F)cc2)CCC1=O ZINC000293855113 565187436 /nfs/dbraw/zinc/18/74/36/565187436.db2.gz UIHYZMVNARZNBW-GUYCJALGSA-N 1 1 381.245 3.481 10 0 GGAEMO CCC1(CC)C[N@H+](CCC(=O)Nc2cc(Cl)ccc2OC)CC[S@@]1=O ZINC000185268784 565191496 /nfs/dbraw/zinc/19/14/96/565191496.db2.gz KQXIKMAUUWLMKM-VWLOTQADSA-N 1 1 386.945 3.300 10 0 GGAEMO CCC1(CC)C[N@@H+](CCC(=O)Nc2cc(Cl)ccc2OC)CC[S@@]1=O ZINC000185268784 565191499 /nfs/dbraw/zinc/19/14/99/565191499.db2.gz KQXIKMAUUWLMKM-VWLOTQADSA-N 1 1 386.945 3.300 10 0 GGAEMO CC(C)C[C@@H](CO)[N@H+](C)Cc1nc(Cc2cccc(Br)c2)no1 ZINC000185314975 565195691 /nfs/dbraw/zinc/19/56/91/565195691.db2.gz NFRPBZPIDCLZGR-HNNXBMFYSA-N 1 1 382.302 3.262 10 0 GGAEMO CC(C)C[C@@H](CO)[N@@H+](C)Cc1nc(Cc2cccc(Br)c2)no1 ZINC000185314975 565195694 /nfs/dbraw/zinc/19/56/94/565195694.db2.gz NFRPBZPIDCLZGR-HNNXBMFYSA-N 1 1 382.302 3.262 10 0 GGAEMO CC[N@H+](CCc1nccs1)CC(=O)Nc1sc(C)c(C)c1C(=O)OC ZINC000159220870 565197965 /nfs/dbraw/zinc/19/79/65/565197965.db2.gz WMHOQRFAEYEGNP-UHFFFAOYSA-N 1 1 381.523 3.111 10 0 GGAEMO CC[N@@H+](CCc1nccs1)CC(=O)Nc1sc(C)c(C)c1C(=O)OC ZINC000159220870 565197968 /nfs/dbraw/zinc/19/79/68/565197968.db2.gz WMHOQRFAEYEGNP-UHFFFAOYSA-N 1 1 381.523 3.111 10 0 GGAEMO O=C1[C@@H](Nc2cc[nH+]c3cc(Br)ccc23)CCN1C1CCOCC1 ZINC000371825393 565212149 /nfs/dbraw/zinc/21/21/49/565212149.db2.gz TWQNFWWWMKZFTR-INIZCTEOSA-N 1 1 390.281 3.189 10 0 GGAEMO O[C@@H](COC1CCOCC1)C[N@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000371896938 565214101 /nfs/dbraw/zinc/21/41/01/565214101.db2.gz DLOWSNSHVQZJBL-SJLPKXTDSA-N 1 1 384.314 3.143 10 0 GGAEMO C[N@H+](Cc1cc(Br)cc(Br)c1N)C[C@@H]1CCCO1 ZINC000185719661 565218226 /nfs/dbraw/zinc/21/82/26/565218226.db2.gz PNJGYBFZPHIWOD-NSHDSACASA-N 1 1 378.108 3.405 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(C(=O)COc2ccc(Br)cc2F)CC1 ZINC000372246108 565228661 /nfs/dbraw/zinc/22/86/61/565228661.db2.gz ACQSEOMAJJFHCM-UHFFFAOYSA-N 1 1 396.260 3.336 10 0 GGAEMO CC[C@@H]1CN(C(=O)c2ccc(Cl)cc2C(F)(F)F)CC[N@H+]1C[C@@H](C)O ZINC000185912058 565228596 /nfs/dbraw/zinc/22/85/96/565228596.db2.gz ZDZDKZRIQAATIF-DGCLKSJQSA-N 1 1 378.822 3.276 10 0 GGAEMO CC[C@H](Cc1ccccc1Br)[N@@H+](C)C[C@@H](C)CS(C)(=O)=O ZINC000185923316 565228930 /nfs/dbraw/zinc/22/89/30/565228930.db2.gz MRMBECHRMDQNHJ-UKRRQHHQSA-N 1 1 376.360 3.383 10 0 GGAEMO Cc1ccc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(F)cc2)c(Br)n1 ZINC000372304185 565229557 /nfs/dbraw/zinc/22/95/57/565229557.db2.gz BNTWPDQVNIOXDT-HZPDHXFCSA-N 1 1 392.272 3.467 10 0 GGAEMO Cc1ccc(C(=O)N[C@@H]2CC[N@H+](C)[C@@H]2c2ccc(F)cc2)c(Br)n1 ZINC000372304185 565229562 /nfs/dbraw/zinc/22/95/62/565229562.db2.gz BNTWPDQVNIOXDT-HZPDHXFCSA-N 1 1 392.272 3.467 10 0 GGAEMO O=C1C[C@H]([C@H]2CCCC[N@@H+]2Cc2cc(Br)cc3cccnc32)CN1 ZINC000372334640 565232608 /nfs/dbraw/zinc/23/26/08/565232608.db2.gz RVMYZUBVPZCXJI-WMLDXEAASA-N 1 1 388.309 3.488 10 0 GGAEMO O=C(C1CC[NH+](C[C@H](O)COCc2ccc(Cl)cc2)CC1)C(F)(F)F ZINC000186019481 565235791 /nfs/dbraw/zinc/23/57/91/565235791.db2.gz QKAOTQOGVWXCJC-HNNXBMFYSA-N 1 1 379.806 3.061 10 0 GGAEMO Brc1ccc([C@H]([NH2+]CCN2CCCCC2)c2cncnc2)cc1 ZINC000186099511 565239746 /nfs/dbraw/zinc/23/97/46/565239746.db2.gz YZDWQKZQQIYDEB-SFHVURJKSA-N 1 1 375.314 3.404 10 0 GGAEMO CC[N@H+]1CC[C@@H](CN[C@@H](c2ccc(Br)cc2)c2cncnc2)C1 ZINC000186116803 565241226 /nfs/dbraw/zinc/24/12/26/565241226.db2.gz RAEVKBDXWMMJKN-KSSFIOAISA-N 1 1 375.314 3.260 10 0 GGAEMO Brc1ccc([C@H](NC[C@H]2CC[N@H+](C3CC3)C2)c2cncnc2)cc1 ZINC000186105149 565241290 /nfs/dbraw/zinc/24/12/90/565241290.db2.gz MFSGABCZFXSWNE-KUHUBIRLSA-N 1 1 387.325 3.402 10 0 GGAEMO O=C(c1cc(Br)ccc1Br)N1CC[N@H+]2CCC[C@H]2C1 ZINC000160398993 565243642 /nfs/dbraw/zinc/24/36/42/565243642.db2.gz 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ZINC000186298992 565253252 /nfs/dbraw/zinc/25/32/52/565253252.db2.gz CKXPLWRBWLYQPV-LLVKDONJSA-N 1 1 396.285 3.219 10 0 GGAEMO CCOC(=O)c1nn(C)cc1C[NH2+][C@@H](C)c1ccc(OC)c(Br)c1 ZINC000186298977 565253372 /nfs/dbraw/zinc/25/33/72/565253372.db2.gz CKXPLWRBWLYQPV-NSHDSACASA-N 1 1 396.285 3.219 10 0 GGAEMO Cc1nc([C@@H]2CCCN2C(=O)NCC[N@@H+]2CCc3sccc3C2)cs1 ZINC000186383215 565258255 /nfs/dbraw/zinc/25/82/55/565258255.db2.gz GOHWRBHNZJCRKR-INIZCTEOSA-N 1 1 376.551 3.418 10 0 GGAEMO Cc1nc([C@@H]2CCCN2C(=O)NCC[N@H+]2CCc3sccc3C2)cs1 ZINC000186383215 565258261 /nfs/dbraw/zinc/25/82/61/565258261.db2.gz GOHWRBHNZJCRKR-INIZCTEOSA-N 1 1 376.551 3.418 10 0 GGAEMO CC[C@H](CO)[NH+]1CCN(C(=O)Nc2cc(Cl)cc(C(F)(F)F)c2)CC1 ZINC000186376016 565258515 /nfs/dbraw/zinc/25/85/15/565258515.db2.gz FQLQEARJXHPYFF-CQSZACIVSA-N 1 1 379.810 3.279 10 0 GGAEMO CN(C(=O)c1c(Cl)cc(F)cc1Cl)[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000372907903 565260055 /nfs/dbraw/zinc/26/00/55/565260055.db2.gz BFNSVTYVFJXYFL-AWEZNQCLSA-N 1 1 388.314 3.373 10 0 GGAEMO CN(C(=O)c1c(Cl)cc(F)cc1Cl)[C@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000372907903 565260058 /nfs/dbraw/zinc/26/00/58/565260058.db2.gz BFNSVTYVFJXYFL-AWEZNQCLSA-N 1 1 388.314 3.373 10 0 GGAEMO C[C@H](CCN1CCN(C)CC1)[NH2+][C@H]1CCc2c1ccc(F)c2Br ZINC000295423096 565264880 /nfs/dbraw/zinc/26/48/80/565264880.db2.gz OBDGNOHEMCXEBT-DYVFJYSZSA-N 1 1 384.337 3.191 10 0 GGAEMO C[N@H+]1CCC[C@@H](NC(=O)Nc2nnc(SCc3ccc(F)cc3)s2)C1 ZINC000617915794 565267501 /nfs/dbraw/zinc/26/75/01/565267501.db2.gz XCRARHCYNPKJNY-CYBMUJFWSA-N 1 1 381.502 3.185 10 0 GGAEMO O=C(N[C@@H]1CCC[N@H+](CCCO)C1)c1sc2ccccc2c1Br ZINC000295588840 565275186 /nfs/dbraw/zinc/27/51/86/565275186.db2.gz WIXKMUDIOXLZRY-GFCCVEGCSA-N 1 1 397.338 3.240 10 0 GGAEMO COc1cc(Br)ccc1C[NH+]1CCC([C@@H](O)c2ncc[nH]2)CC1 ZINC000373346693 565280025 /nfs/dbraw/zinc/28/00/25/565280025.db2.gz UUWDLXKWZHOPOQ-MRXNPFEDSA-N 1 1 380.286 3.126 10 0 GGAEMO C[NH+](C)[C@@H]1CC[C@@H]2[C@@H](C1)OCCN2Cc1nc2ccc(Br)cc2[nH]1 ZINC000373451766 565286154 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C[C@H]([NH2+][C@@H](Cc1ccccc1)C(=O)N(C)C)c1ncc(Br)cc1F ZINC000187189094 565315686 /nfs/dbraw/zinc/31/56/86/565315686.db2.gz XQPUWIVIUNNVOG-LRDDRELGSA-N 1 1 394.288 3.333 10 0 GGAEMO CCOc1cc(C[NH+]2CCC(C(=O)N(C)C)CC2)cc(Br)c1OC ZINC000162607028 565322100 /nfs/dbraw/zinc/32/21/00/565322100.db2.gz NUDRXTGZQTWCBV-UHFFFAOYSA-N 1 1 399.329 3.157 10 0 GGAEMO Cn1cc[nH+]c1CC1CCN(C(=O)COc2cccc(Br)c2)CC1 ZINC000162724227 565325878 /nfs/dbraw/zinc/32/58/78/565325878.db2.gz UEZRVLJZNKXKOH-UHFFFAOYSA-N 1 1 392.297 3.043 10 0 GGAEMO Cn1cc[nH+]c1CC1CCN(C(=O)c2cc(F)cc(Br)c2)CC1 ZINC000162716944 565325975 /nfs/dbraw/zinc/32/59/75/565325975.db2.gz MYHQYCCASDJYFF-UHFFFAOYSA-N 1 1 380.261 3.417 10 0 GGAEMO Fc1cc2c(cc1Br)[C@@H]([NH2+]Cc1ccc(-n3cncn3)cc1)CO2 ZINC000374219727 565326656 /nfs/dbraw/zinc/32/66/56/565326656.db2.gz YNHWHPHAQVIQJS-INIZCTEOSA-N 1 1 389.228 3.392 10 0 GGAEMO CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2cc(Br)c(C)[nH]c2=O)C1 ZINC000163159096 565337502 /nfs/dbraw/zinc/33/75/02/565337502.db2.gz KEBBQQYUERWQLR-LBPRGKRZSA-N 1 1 393.285 3.094 10 0 GGAEMO C[C@@H]([NH2+][C@H]1CCN(C2CCOCC2)C1=O)c1ccc(F)cc1Br ZINC000374527858 565343662 /nfs/dbraw/zinc/34/36/62/565343662.db2.gz RXDSGPNAAVBKTO-BZNIZROVSA-N 1 1 385.277 3.019 10 0 GGAEMO C[C@H]([NH2+]CC(=O)Nc1cc(Cl)ccc1F)c1ccc(S(C)(=O)=O)cc1 ZINC000163333585 565344033 /nfs/dbraw/zinc/34/40/33/565344033.db2.gz FVQRBCILVZAASQ-NSHDSACASA-N 1 1 384.860 3.172 10 0 GGAEMO C[C@@H](c1ccc(C[N@@H+](C)C2CCN(S(C)(=O)=O)CC2)cc1)C(F)(F)F ZINC000296894421 565344302 /nfs/dbraw/zinc/34/43/02/565344302.db2.gz YIBOUPNKBZWUQX-ZDUSSCGKSA-N 1 1 378.460 3.208 10 0 GGAEMO CS(=O)(=O)N1CC[C@@H](C[N@H+]2CCc3sccc3[C@H]2c2cccs2)C1 ZINC000374774572 565354743 /nfs/dbraw/zinc/35/47/43/565354743.db2.gz BFRFWKQDHDWBNU-GUYCJALGSA-N 1 1 382.576 3.039 10 0 GGAEMO O=C(NC[C@H]1CSCCS1)[C@H]1CCn2c(c[nH+]c2C2CCCCC2)C1 ZINC000374897210 565359090 /nfs/dbraw/zinc/35/90/90/565359090.db2.gz ROHKWYUTKCQPIR-RDJZCZTQSA-N 1 1 379.595 3.458 10 0 GGAEMO C[C@@H]1CC[C@](CO)([N@@H+](C)Cc2nnc(-c3ccccc3Br)o2)C1 ZINC000187938389 565364612 /nfs/dbraw/zinc/36/46/12/565364612.db2.gz KUUJYQHROCLIHL-PXAZEXFGSA-N 1 1 380.286 3.482 10 0 GGAEMO C[C@@H](NC(=O)N1C[C@H]([NH+]2CCOCC2)[C@@H](C)C1)c1cc(Cl)ccc1Cl ZINC000187950691 565365582 /nfs/dbraw/zinc/36/55/82/565365582.db2.gz OMLQBBPIUQYUCP-AHIWAGSCSA-N 1 1 386.323 3.417 10 0 GGAEMO COc1sc(C[N@@H+]2CCC[C@H](c3ccnc(N)n3)C2)cc1Br ZINC000375073194 565367115 /nfs/dbraw/zinc/36/71/15/565367115.db2.gz CXVJPHMLZHGDRE-JTQLQIEISA-N 1 1 383.315 3.101 10 0 GGAEMO COc1sc(C[N@H+]2CCC[C@H](c3ccnc(N)n3)C2)cc1Br ZINC000375073194 565367117 /nfs/dbraw/zinc/36/71/17/565367117.db2.gz CXVJPHMLZHGDRE-JTQLQIEISA-N 1 1 383.315 3.101 10 0 GGAEMO C[C@H]1CC[C@@](CO)([N@@H+](C)CCC(=O)Nc2ccc(Br)cc2F)C1 ZINC000187975464 565367892 /nfs/dbraw/zinc/36/78/92/565367892.db2.gz XQIKBLAXSBCLAO-YVEFUNNKSA-N 1 1 387.293 3.400 10 0 GGAEMO C[C@H]1CC[C@@](CO)([N@@H+](C)CC(=O)Nc2ccc(OC(F)F)c(Cl)c2)C1 ZINC000188021700 565372020 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COCC[N@H+]1CCC[C@H]1CNC(=O)CCCc1ccc(Br)s1 ZINC000170809235 565392844 /nfs/dbraw/zinc/39/28/44/565392844.db2.gz UWDMSHJZEDFCOB-ZDUSSCGKSA-N 1 1 389.359 3.060 10 0 GGAEMO CCCn1cc(C[N@H+]2CCCN(Cc3cncc(Br)c3)CC2)cn1 ZINC000170944288 565401002 /nfs/dbraw/zinc/40/10/02/565401002.db2.gz REORVNPGAZXXDM-UHFFFAOYSA-N 1 1 392.345 3.159 10 0 GGAEMO COc1cc(Br)ccc1CNC(=O)[C@H](c1ccccc1)[NH+](C)C ZINC000188439833 565401515 /nfs/dbraw/zinc/40/15/15/565401515.db2.gz YJDOUKNCPJWHCV-KRWDZBQOSA-N 1 1 377.282 3.377 10 0 GGAEMO O=C(/C=C/c1cc(Br)ccc1F)NC[C@@H]1CCc2[nH+]ccn2C1 ZINC000275306309 565402615 /nfs/dbraw/zinc/40/26/15/565402615.db2.gz ATWPPFDDHFSBTE-QSLRECBCSA-N 1 1 378.245 3.177 10 0 GGAEMO CCOc1cc(C[N@H+](CCCO)Cc2ccccn2)cc(Br)c1O ZINC000298212265 565403739 /nfs/dbraw/zinc/40/37/39/565403739.db2.gz ZEPHJHRFKCGPGS-UHFFFAOYSA-N 1 1 395.297 3.333 10 0 GGAEMO CCOc1cc(C[N@@H+](CCCO)Cc2ccccn2)cc(Br)c1O ZINC000298212265 565403743 /nfs/dbraw/zinc/40/37/43/565403743.db2.gz ZEPHJHRFKCGPGS-UHFFFAOYSA-N 1 1 395.297 3.333 10 0 GGAEMO Cc1cccc(N2CCC(NC(=O)Nc3cccc(Br)n3)CC2)[nH+]1 ZINC000188507015 565405491 /nfs/dbraw/zinc/40/54/91/565405491.db2.gz WVYBFARTKPCPFR-UHFFFAOYSA-N 1 1 390.285 3.338 10 0 GGAEMO CN(C(=O)c1nc(Br)cs1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000275417266 565409757 /nfs/dbraw/zinc/40/97/57/565409757.db2.gz BUMJKMFALPHQNY-CYBMUJFWSA-N 1 1 380.311 3.252 10 0 GGAEMO C[C@@H]([NH2+]Cc1csc(-c2cccs2)n1)c1ccc(S(N)(=O)=O)cc1 ZINC000171110232 565410074 /nfs/dbraw/zinc/41/00/74/565410074.db2.gz PJZRLLGLHPRSQE-LLVKDONJSA-N 1 1 379.532 3.370 10 0 GGAEMO C[C@@H]([NH2+]Cc1csc(-c2ccsc2)n1)c1ccc(S(N)(=O)=O)cc1 ZINC000171110510 565410357 /nfs/dbraw/zinc/41/03/57/565410357.db2.gz AVJUTWIFDXQPAG-LLVKDONJSA-N 1 1 379.532 3.370 10 0 GGAEMO C[N@@H+](Cc1ccc(F)cc1Br)C1CCN(c2cnccn2)CC1 ZINC000375907810 565412923 /nfs/dbraw/zinc/41/29/23/565412923.db2.gz ZHJMBUHDSBWUEG-UHFFFAOYSA-N 1 1 379.277 3.479 10 0 GGAEMO C[N@@H+](CCOc1ccccc1Br)C1CCN(c2cnccn2)CC1 ZINC000375928194 565414531 /nfs/dbraw/zinc/41/45/31/565414531.db2.gz QVMJDSICTDRHLK-UHFFFAOYSA-N 1 1 391.313 3.219 10 0 GGAEMO Cc1c(Br)cccc1NC(=O)N1CCC([N@@H+]2CCO[C@@H](C)C2)CC1 ZINC000171152923 565414643 /nfs/dbraw/zinc/41/46/43/565414643.db2.gz ZEKRHYDUONOGHA-ZDUSSCGKSA-N 1 1 396.329 3.475 10 0 GGAEMO O=C(CC[N@H+]1CCC[C@H]1c1cc[nH]n1)Nc1ccc(Br)cc1F ZINC000298470371 565415628 /nfs/dbraw/zinc/41/56/28/565415628.db2.gz IQCWFUGBARAEFS-HNNXBMFYSA-N 1 1 381.249 3.477 10 0 GGAEMO COc1cc(Br)ccc1[C@@H](C)NC(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000188686666 565417938 /nfs/dbraw/zinc/41/79/38/565417938.db2.gz FUWXWDHGANQQEZ-OLZOCXBDSA-N 1 1 396.329 3.302 10 0 GGAEMO COc1cc(Br)ccc1[C@H](C)NC(=O)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC000188686644 565418403 /nfs/dbraw/zinc/41/84/03/565418403.db2.gz FUWXWDHGANQQEZ-STQMWFEESA-N 1 1 396.329 3.302 10 0 GGAEMO COC(=O)c1ccc(C[NH2+][C@H](c2cncc(Br)c2)C2CC2)nc1 ZINC000298542853 565419230 /nfs/dbraw/zinc/41/92/30/565419230.db2.gz NHCKGZQHEAWTGJ-INIZCTEOSA-N 1 1 376.254 3.267 10 0 GGAEMO COC(=O)[C@H]1CCC[N@H+](Cc2coc(-c3ccc(Br)cc3)n2)C1 ZINC000171236466 565420681 /nfs/dbraw/zinc/42/06/81/565420681.db2.gz CUSJIWYUJCMSKY-ZDUSSCGKSA-N 1 1 379.254 3.489 10 0 GGAEMO COC(=O)[C@H]1CCC[N@@H+](Cc2coc(-c3ccc(Br)cc3)n2)C1 ZINC000171236466 565420687 /nfs/dbraw/zinc/42/06/87/565420687.db2.gz CUSJIWYUJCMSKY-ZDUSSCGKSA-N 1 1 379.254 3.489 10 0 GGAEMO CC[NH+](CC)[C@@H](CNS(=O)(=O)Cc1cccc(OC)c1)c1ccsc1 ZINC000171282060 565424282 /nfs/dbraw/zinc/42/42/82/565424282.db2.gz XOFRWSHWJPGFML-SFHVURJKSA-N 1 1 382.551 3.259 10 0 GGAEMO COC(=O)[C@H](C)C[N@@H+](C[C@H](O)COc1c(Cl)cccc1Cl)C1CC1 ZINC000171300303 565425071 /nfs/dbraw/zinc/42/50/71/565425071.db2.gz CVLJGVPGYPZZAL-YPMHNXCESA-N 1 1 376.280 3.007 10 0 GGAEMO CC[N@H+]1CCC[C@@H](NC(=O)N(CCCO)Cc2ccc(Cl)c(Cl)c2)C1 ZINC000171316854 565426139 /nfs/dbraw/zinc/42/61/39/565426139.db2.gz VIFNAKAZNYQLOV-OAHLLOKOSA-N 1 1 388.339 3.372 10 0 GGAEMO COC(=O)[C@@H]1CC[N@@H+]([C@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)C1 ZINC000298743620 565427566 /nfs/dbraw/zinc/42/75/66/565427566.db2.gz TYTNCGJWVHVTDW-NXEZZACHSA-N 1 1 378.778 3.181 10 0 GGAEMO COC(=O)[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)C1 ZINC000298743620 565427571 /nfs/dbraw/zinc/42/75/71/565427571.db2.gz TYTNCGJWVHVTDW-NXEZZACHSA-N 1 1 378.778 3.181 10 0 GGAEMO Cn1cc([C@@H]2CCC[N@H+]2CCC(=O)Nc2ccc(Br)cc2F)cn1 ZINC000171412508 565430123 /nfs/dbraw/zinc/43/01/23/565430123.db2.gz MRUNYNRIRWIWHF-INIZCTEOSA-N 1 1 395.276 3.487 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)Cc1cccc(Br)c1C ZINC000188958686 565435233 /nfs/dbraw/zinc/43/52/33/565435233.db2.gz UNXQUPAZRXXTCS-INIZCTEOSA-N 1 1 376.298 3.496 10 0 GGAEMO CC[C@H]1CN(CCOc2cc(F)cc(Br)c2)CC[N@H+]1CCOC ZINC000188956690 565435541 /nfs/dbraw/zinc/43/55/41/565435541.db2.gz LYWSSCSJKKTEHH-INIZCTEOSA-N 1 1 389.309 3.010 10 0 GGAEMO Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+](C)CC1(CO)CC1 ZINC000188961400 565435660 /nfs/dbraw/zinc/43/56/60/565435660.db2.gz PRULDILVTKCAHE-UHFFFAOYSA-N 1 1 378.314 3.456 10 0 GGAEMO C[C@H](NC(=O)C[N@@H+]1CCC[C@H](n2cncn2)C1)c1ccc(Cl)c(Cl)c1 ZINC000171528691 565436085 /nfs/dbraw/zinc/43/60/85/565436085.db2.gz CSIPDJJWQSHKTG-JSGCOSHPSA-N 1 1 382.295 3.099 10 0 GGAEMO C[C@H](NC(=O)C[N@H+]1CCC[C@H](n2cncn2)C1)c1ccc(Cl)c(Cl)c1 ZINC000171528691 565436092 /nfs/dbraw/zinc/43/60/92/565436092.db2.gz CSIPDJJWQSHKTG-JSGCOSHPSA-N 1 1 382.295 3.099 10 0 GGAEMO C[C@H]1CN(C(=O)Nc2cccc(Cl)c2SCC(F)F)CC[N@@H+]1CCO ZINC000188980528 565436750 /nfs/dbraw/zinc/43/67/50/565436750.db2.gz CFHGMNZINWZWFH-NSHDSACASA-N 1 1 393.887 3.228 10 0 GGAEMO C[C@H]1CN(C(=O)Nc2cccc(Cl)c2SCC(F)F)CC[N@H+]1CCO ZINC000188980528 565436754 /nfs/dbraw/zinc/43/67/54/565436754.db2.gz CFHGMNZINWZWFH-NSHDSACASA-N 1 1 393.887 3.228 10 0 GGAEMO NC(=O)CCCCC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000188994683 565437482 /nfs/dbraw/zinc/43/74/82/565437482.db2.gz GECFXZKCBMZPKY-UHFFFAOYSA-N 1 1 386.323 3.120 10 0 GGAEMO O=C(C[N@@H+]1CC[C@@H](CNc2ccccn2)C1)Nc1ccc(Br)cc1 ZINC000171648206 565441793 /nfs/dbraw/zinc/44/17/93/565441793.db2.gz PBTRNHPACSRDJQ-AWEZNQCLSA-N 1 1 389.297 3.217 10 0 GGAEMO O=C(C[N@H+]1CC[C@@H](CNc2ccccn2)C1)Nc1ccc(Br)cc1 ZINC000171648206 565441796 /nfs/dbraw/zinc/44/17/96/565441796.db2.gz PBTRNHPACSRDJQ-AWEZNQCLSA-N 1 1 389.297 3.217 10 0 GGAEMO O=C(C[N@@H+]1CC[C@H](CNc2ccccn2)C1)Nc1ccc(Br)cc1 ZINC000171648209 565442226 /nfs/dbraw/zinc/44/22/26/565442226.db2.gz PBTRNHPACSRDJQ-CQSZACIVSA-N 1 1 389.297 3.217 10 0 GGAEMO O=C(C[N@H+]1CC[C@H](CNc2ccccn2)C1)Nc1ccc(Br)cc1 ZINC000171648209 565442230 /nfs/dbraw/zinc/44/22/30/565442230.db2.gz PBTRNHPACSRDJQ-CQSZACIVSA-N 1 1 389.297 3.217 10 0 GGAEMO C[N@H+](CCCCO)CC(=O)N1N=C(c2cccs2)C[C@H]1c1cccs1 ZINC000276336557 565444528 /nfs/dbraw/zinc/44/45/28/565444528.db2.gz GOVLBZAWFGGHHW-HNNXBMFYSA-N 1 1 377.535 3.192 10 0 GGAEMO C[N@@H+](CCCCO)CC(=O)N1N=C(c2cccs2)C[C@H]1c1cccs1 ZINC000276336557 565444533 /nfs/dbraw/zinc/44/45/33/565444533.db2.gz GOVLBZAWFGGHHW-HNNXBMFYSA-N 1 1 377.535 3.192 10 0 GGAEMO COc1cc(Br)ccc1[C@@H](C)NC(=O)CCCC[NH+]1CCOCC1 ZINC000189137482 565446229 /nfs/dbraw/zinc/44/62/29/565446229.db2.gz KQPBNCBCMOQGEZ-CQSZACIVSA-N 1 1 399.329 3.137 10 0 GGAEMO C[C@@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)N1CC[NH+](C2CC2)CC1 ZINC000299342635 565447005 /nfs/dbraw/zinc/44/70/05/565447005.db2.gz OVVBMNFZFLBGIE-NSHDSACASA-N 1 1 375.822 3.466 10 0 GGAEMO C[N@@H+](Cc1ccc(Br)cc1N1CCOCC1)[C@H]1CC[C@H](O)CC1 ZINC000276408258 565448627 /nfs/dbraw/zinc/44/86/27/565448627.db2.gz DZHFWHHTTOBLDQ-QAQDUYKDSA-N 1 1 383.330 3.021 10 0 GGAEMO O=C(NC[C@H]1C[N@H+]2CCC[C@H]2CO1)Nc1cc(Cl)ccc1C(F)(F)F ZINC000376742825 565452423 /nfs/dbraw/zinc/45/24/23/565452423.db2.gz JFLHKZFRDQCVLZ-RYUDHWBXSA-N 1 1 377.794 3.344 10 0 GGAEMO O=C(c1[nH]nc2ccc(Br)cc21)N1CCC(C[NH+]2CCCC2)CC1 ZINC000171880306 565455627 /nfs/dbraw/zinc/45/56/27/565455627.db2.gz GHGILDNDDNHXIY-UHFFFAOYSA-N 1 1 391.313 3.273 10 0 GGAEMO C[C@H](CCc1ccc(Br)cc1)NC(=O)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000171903866 565456423 /nfs/dbraw/zinc/45/64/23/565456423.db2.gz GXBKBRNYCUXIOA-RHSMWYFYSA-N 1 1 380.330 3.260 10 0 GGAEMO CC(C)(CNC(=O)N1CC[N@H+]2CCC[C@H]2C1)c1ccc(Br)cc1 ZINC000171902270 565456519 /nfs/dbraw/zinc/45/65/19/565456519.db2.gz KXHAMZMTJZQVNW-INIZCTEOSA-N 1 1 380.330 3.216 10 0 GGAEMO CC(C)(CNC(=O)N1CC[N@H+]2CCC[C@@H]2C1)c1ccc(Br)cc1 ZINC000171902269 565456805 /nfs/dbraw/zinc/45/68/05/565456805.db2.gz KXHAMZMTJZQVNW-MRXNPFEDSA-N 1 1 380.330 3.216 10 0 GGAEMO C[NH+](C)[C@@H](CNC(=O)[C@@H]1CCCN1c1nccs1)c1ccccc1Cl ZINC000171946909 565459474 /nfs/dbraw/zinc/45/94/74/565459474.db2.gz ZFEJFYZAELZBNM-HOTGVXAUSA-N 1 1 378.929 3.184 10 0 GGAEMO COc1cc(Br)ccc1[C@@H](C)NC(=O)NC[C@@H](C)[N@@H+](C)C1CC1 ZINC000189362363 565461614 /nfs/dbraw/zinc/46/16/14/565461614.db2.gz WOAJKCRQZWPEFI-VXGBXAGGSA-N 1 1 384.318 3.301 10 0 GGAEMO C[C@@H](c1ccc(Br)cc1)N1CC[NH+](C[C@@H](O)CC(F)(F)F)CC1 ZINC000189381430 565462615 /nfs/dbraw/zinc/46/26/15/565462615.db2.gz UYKZGIAQIQPKFZ-WFASDCNBSA-N 1 1 395.263 3.441 10 0 GGAEMO O[C@@H](C[NH+]1CCN(Cc2ccc(Br)c(F)c2)CC1)CC(F)(F)F ZINC000189386811 565462792 /nfs/dbraw/zinc/46/27/92/565462792.db2.gz YFNLQGYGAIAJTB-GFCCVEGCSA-N 1 1 399.226 3.019 10 0 GGAEMO C[C@H]1OCCC[C@@H]1C(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000189442919 565466003 /nfs/dbraw/zinc/46/60/03/565466003.db2.gz LUTQJWBIVJOCSJ-KDOFPFPSSA-N 1 1 395.341 3.345 10 0 GGAEMO COc1cc(Br)ccc1[C@@H](C)NC(=O)NC[C@@H]1CCC[N@@H+](C)C1 ZINC000189489936 565468898 /nfs/dbraw/zinc/46/88/98/565468898.db2.gz MPXBTBGQUBWEAB-OLZOCXBDSA-N 1 1 384.318 3.160 10 0 GGAEMO COc1ccc([C@H](C)NC(=O)N2C[C@H]3CCC[N@H+]3C[C@H]2C)cc1Br ZINC000172241165 565474061 /nfs/dbraw/zinc/47/40/61/565474061.db2.gz QFLGFKSFBWVUSF-VNHYZAJKSA-N 1 1 396.329 3.397 10 0 GGAEMO CCc1nc(C[NH+]2CCC(CN=c3nc([C@H](C)OC)[n-]s3)CC2)cs1 ZINC000377309017 565474743 /nfs/dbraw/zinc/47/47/43/565474743.db2.gz OUIOKNUVJLKVJB-LBPRGKRZSA-N 1 1 381.571 3.010 10 0 GGAEMO O=C(Nc1cccc(Cl)c1)N1CCC[N@@H+](C[C@H](O)CC(F)(F)F)CC1 ZINC000189629233 565478445 /nfs/dbraw/zinc/47/84/45/565478445.db2.gz ARLRLKKLZMNNCJ-CQSZACIVSA-N 1 1 379.810 3.193 10 0 GGAEMO O=C(Nc1cccc(Cl)c1)N1CCC[N@H+](C[C@H](O)CC(F)(F)F)CC1 ZINC000189629233 565478450 /nfs/dbraw/zinc/47/84/50/565478450.db2.gz ARLRLKKLZMNNCJ-CQSZACIVSA-N 1 1 379.810 3.193 10 0 GGAEMO CC[NH+]1CCN(C[C@@H](C)CNC(=O)c2c(Cl)cc(F)cc2Cl)CC1 ZINC000277177487 565481516 /nfs/dbraw/zinc/48/15/16/565481516.db2.gz DPMSYWKWYFDXFJ-LBPRGKRZSA-N 1 1 376.303 3.136 10 0 GGAEMO O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000377530236 565484817 /nfs/dbraw/zinc/48/48/17/565484817.db2.gz NGZPHQQKTDZREM-SFHVURJKSA-N 1 1 389.297 3.055 10 0 GGAEMO O=C(c1n[nH]c(-c2ccccc2)c1Br)N1CCC[C@]2(CC[NH2+]C2)C1 ZINC000377530235 565485025 /nfs/dbraw/zinc/48/50/25/565485025.db2.gz NGZPHQQKTDZREM-GOSISDBHSA-N 1 1 389.297 3.055 10 0 GGAEMO CCC[N@H+]1CC[C@@H](CNC(=O)N2CCc3cccc(Br)c3C2)C1 ZINC000172456266 565486342 /nfs/dbraw/zinc/48/63/42/565486342.db2.gz UXBMPLZBVHODDC-AWEZNQCLSA-N 1 1 380.330 3.249 10 0 GGAEMO C[C@@H]1C[N@H+](CCCNC(=O)C2(c3ccccc3Br)CC2)C[C@H](C)O1 ZINC000189847768 565492123 /nfs/dbraw/zinc/49/21/23/565492123.db2.gz AFCYOXKJGVYIRC-GASCZTMLSA-N 1 1 395.341 3.096 10 0 GGAEMO C[NH+](C)CCN1CCC(CNC(=O)c2c(Cl)cc(F)cc2Cl)CC1 ZINC000277377104 565492388 /nfs/dbraw/zinc/49/23/88/565492388.db2.gz ZEMRIORPUZIDQE-UHFFFAOYSA-N 1 1 376.303 3.136 10 0 GGAEMO C[C@H]([NH2+][C@H]1CCN(C)[C@H]1c1ccc(F)cc1)c1ncc(Br)cn1 ZINC000377680517 565492958 /nfs/dbraw/zinc/49/29/58/565492958.db2.gz VRTBYOWQLUQEJG-UVBJJODRSA-N 1 1 379.277 3.474 10 0 GGAEMO CSc1ncc(Cl)c(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000172575401 565493138 /nfs/dbraw/zinc/49/31/38/565493138.db2.gz IFUMUFCDEBAPKO-ZDUSSCGKSA-N 1 1 376.913 3.198 10 0 GGAEMO CSc1ncc(Cl)c(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000172575401 565493142 /nfs/dbraw/zinc/49/31/42/565493142.db2.gz IFUMUFCDEBAPKO-ZDUSSCGKSA-N 1 1 376.913 3.198 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CN(Cc1ccncc1)c1ncc(Br)cn1 ZINC000301540756 565493754 /nfs/dbraw/zinc/49/37/54/565493754.db2.gz JWZUFDASKNISRB-MRXNPFEDSA-N 1 1 376.302 3.125 10 0 GGAEMO O=C(Nc1nncs1)C1CC[NH+](Cc2cscc2Br)CC1 ZINC000377714532 565494470 /nfs/dbraw/zinc/49/44/70/565494470.db2.gz HRSIAIQLZQYZCL-UHFFFAOYSA-N 1 1 387.328 3.213 10 0 GGAEMO CCOc1c(Br)cc(C[NH2+][C@H]2CCc3[nH]cnc3C2)cc1OC ZINC000377729869 565495454 /nfs/dbraw/zinc/49/54/54/565495454.db2.gz ZDBUPTJVMQITJP-LBPRGKRZSA-N 1 1 380.286 3.227 10 0 GGAEMO COc1c(Br)cccc1C[N@@H+]1CCC[C@@H](c2ccnc(N)n2)C1 ZINC000377728705 565496083 /nfs/dbraw/zinc/49/60/83/565496083.db2.gz WIVMWJWBYQISAX-GFCCVEGCSA-N 1 1 377.286 3.040 10 0 GGAEMO COc1c(Br)cccc1C[N@H+]1CCC[C@@H](c2ccnc(N)n2)C1 ZINC000377728705 565496087 /nfs/dbraw/zinc/49/60/87/565496087.db2.gz WIVMWJWBYQISAX-GFCCVEGCSA-N 1 1 377.286 3.040 10 0 GGAEMO COc1cc(Br)cc(C)c1NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000377779459 565498425 /nfs/dbraw/zinc/49/84/25/565498425.db2.gz YKEYZYRAJDSYSP-NSHDSACASA-N 1 1 379.258 3.168 10 0 GGAEMO Cc1cc[nH+]c(N2CCN(c3ncnc4ccc(Br)cc43)CC2)c1 ZINC000301634823 565500869 /nfs/dbraw/zinc/50/08/69/565500869.db2.gz KNXPNERLQGBWFY-UHFFFAOYSA-N 1 1 384.281 3.422 10 0 GGAEMO C[N@H+](Cc1coc(-c2ccc(I)cc2)n1)CC1(CO)CC1 ZINC000190011439 565501820 /nfs/dbraw/zinc/50/18/20/565501820.db2.gz COQRGVGTTPDZFX-UHFFFAOYSA-N 1 1 398.244 3.151 10 0 GGAEMO C[N@@H+](Cc1coc(-c2ccc(I)cc2)n1)CC1(CO)CC1 ZINC000190011439 565501823 /nfs/dbraw/zinc/50/18/23/565501823.db2.gz COQRGVGTTPDZFX-UHFFFAOYSA-N 1 1 398.244 3.151 10 0 GGAEMO Brc1csc(-c2noc(CN3CC[N@H+]4CCCC[C@@H]4C3)n2)c1 ZINC000172803161 565504888 /nfs/dbraw/zinc/50/48/88/565504888.db2.gz QOKPVCUFUXRRFX-GFCCVEGCSA-N 1 1 383.315 3.231 10 0 GGAEMO Cc1ccc(NC(=O)[C@@H](C)N2CC[N@H+]3CCCC[C@@H]3C2)c(Br)c1 ZINC000172801984 565505221 /nfs/dbraw/zinc/50/52/21/565505221.db2.gz YUDYCWNXCVQZRN-HUUCEWRRSA-N 1 1 380.330 3.255 10 0 GGAEMO Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1CC[C@@H](O)[C@H](C)C1 ZINC000190057832 565505538 /nfs/dbraw/zinc/50/55/38/565505538.db2.gz AVTHREXUFSHSEN-KZULUSFZSA-N 1 1 378.314 3.454 10 0 GGAEMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1n[nH]c2ccc(Br)cc21 ZINC000172834039 565506340 /nfs/dbraw/zinc/50/63/40/565506340.db2.gz FVGSEUKWEDLCHP-ZDUSSCGKSA-N 1 1 379.302 3.272 10 0 GGAEMO CN(CC[C@@H]1CCCC[N@@H+]1C)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000172834039 565506344 /nfs/dbraw/zinc/50/63/44/565506344.db2.gz FVGSEUKWEDLCHP-ZDUSSCGKSA-N 1 1 379.302 3.272 10 0 GGAEMO CN(CC[C@@H]1CCCC[N@H+]1C)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000172834039 565506347 /nfs/dbraw/zinc/50/63/47/565506347.db2.gz FVGSEUKWEDLCHP-ZDUSSCGKSA-N 1 1 379.302 3.272 10 0 GGAEMO C[NH+](C)[C@@H](CNC(=O)C1(c2ccccc2Br)CC1)c1ccco1 ZINC000190136880 565510951 /nfs/dbraw/zinc/51/09/51/565510951.db2.gz DEYAUAVLNHRTDE-HNNXBMFYSA-N 1 1 377.282 3.493 10 0 GGAEMO CCC[C@H]1CN(c2ncnc3ccc(Br)cc32)CC[N@H+]1CCOC ZINC000301934882 565520187 /nfs/dbraw/zinc/52/01/87/565520187.db2.gz QOVMWWLFWDMMNA-HNNXBMFYSA-N 1 1 393.329 3.329 10 0 GGAEMO NC(=O)c1c(F)cc(Br)cc1N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000301942647 565520297 /nfs/dbraw/zinc/52/02/97/565520297.db2.gz XLSYCSVICMDKFQ-ABAIWWIYSA-N 1 1 396.304 3.140 10 0 GGAEMO Cc1[nH+]ccn1CCCCNC(=O)c1[nH]nc2ccc(Br)cc21 ZINC000173024384 565520368 /nfs/dbraw/zinc/52/03/68/565520368.db2.gz VNIYYYLDNTYGKD-UHFFFAOYSA-N 1 1 376.258 3.041 10 0 GGAEMO CCc1cnc(CCNC(=O)C2CC[NH+](Cc3csc(C)n3)CC2)s1 ZINC000173027781 565521251 /nfs/dbraw/zinc/52/12/51/565521251.db2.gz GYCKCHOBJMMUIT-UHFFFAOYSA-N 1 1 378.567 3.041 10 0 GGAEMO C[NH+]1CCC2(CCCN2C(=O)c2[nH]nc3ccc(Br)cc32)CC1 ZINC000378334852 565522726 /nfs/dbraw/zinc/52/27/26/565522726.db2.gz NPBSVYZCDVILDK-UHFFFAOYSA-N 1 1 377.286 3.026 10 0 GGAEMO O=C1C[C@H]([C@H]2CCCC[N@@H+]2CC2=Cc3cc(Br)ccc3OC2)CN1 ZINC000378368964 565523409 /nfs/dbraw/zinc/52/34/09/565523409.db2.gz IFKLIASESSLVBI-DOTOQJQBSA-N 1 1 391.309 3.216 10 0 GGAEMO Cn1cc([C@H](O)C[C@H]2CCC[N@@H+]2Cc2ccc(Br)c(F)c2)cn1 ZINC000378357147 565523764 /nfs/dbraw/zinc/52/37/64/565523764.db2.gz CALRLMKJISFFLB-RHSMWYFYSA-N 1 1 382.277 3.410 10 0 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565897368 /nfs/dbraw/zinc/89/73/68/565897368.db2.gz JJSONNPTCXKEBS-NSHDSACASA-N 1 1 377.204 3.388 10 0 GGAEMO O=C(c1ccc(Br)c(C(F)(F)F)c1)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000178107607 565897422 /nfs/dbraw/zinc/89/74/22/565897422.db2.gz JJSONNPTCXKEBS-LLVKDONJSA-N 1 1 377.204 3.388 10 0 GGAEMO CC(C)C[C@@H](C[NH+]1CCCC1)N[C@@H](C)Cn1cc(Br)ccc1=O ZINC000414137689 565898394 /nfs/dbraw/zinc/89/83/94/565898394.db2.gz KBCNWCQXKQLFOA-RDJZCZTQSA-N 1 1 384.362 3.099 10 0 GGAEMO C[C@@H]([NH2+]C[C@@H]1CCCCN1S(C)(=O)=O)c1csc(-c2ccccc2)n1 ZINC000414166422 565900752 /nfs/dbraw/zinc/90/07/52/565900752.db2.gz QXTCAZBFCQJLKC-ZBFHGGJFSA-N 1 1 379.551 3.275 10 0 GGAEMO C[C@@H](Cn1cc(Br)ccc1=O)N[C@@H](C[NH+](C)C)c1ccc(F)cc1 ZINC000414162904 565900862 /nfs/dbraw/zinc/90/08/62/565900862.db2.gz MKUQNOVDZITWKO-GUYCJALGSA-N 1 1 396.304 3.031 10 0 GGAEMO Cc1cc(Br)cc(C)c1N1CCC[C@H]([NH2+]Cc2nccn2C)C1=O ZINC000285446005 565907823 /nfs/dbraw/zinc/90/78/23/565907823.db2.gz IORHUNKQZCEBSE-HNNXBMFYSA-N 1 1 391.313 3.085 10 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COC(=O)[C@@H]1CSCC[N@@H+](Cc2cn(-c3ccc(Cl)cc3)nc2C)C1 ZINC000414562634 565949364 /nfs/dbraw/zinc/94/93/64/565949364.db2.gz AVBXUINPCYXXTL-HNNXBMFYSA-N 1 1 379.913 3.172 10 0 GGAEMO CCOc1cc(C[N@H+]2CCSC[C@H](C(=O)OC)C2)ccc1OC(F)F ZINC000414573566 565949376 /nfs/dbraw/zinc/94/93/76/565949376.db2.gz ZDNNUUCYZFUGKX-CYBMUJFWSA-N 1 1 375.437 3.025 10 0 GGAEMO CCOc1cccc(C[N@@H+]2CCSC[C@@H](C(=O)OC)C2)c1OC(F)F ZINC000414565384 565949501 /nfs/dbraw/zinc/94/95/01/565949501.db2.gz GLHVGUPFBWZKEN-ZDUSSCGKSA-N 1 1 375.437 3.025 10 0 GGAEMO CCOc1cccc(C[N@H+]2CCSC[C@@H](C(=O)OC)C2)c1OC(F)F ZINC000414565384 565949506 /nfs/dbraw/zinc/94/95/06/565949506.db2.gz GLHVGUPFBWZKEN-ZDUSSCGKSA-N 1 1 375.437 3.025 10 0 GGAEMO COC(=O)[C@H]1CSCC[N@@H+](Cc2cn(-c3ccc(Cl)cc3)nc2C)C1 ZINC000414562635 565950178 /nfs/dbraw/zinc/95/01/78/565950178.db2.gz AVBXUINPCYXXTL-OAHLLOKOSA-N 1 1 379.913 3.172 10 0 GGAEMO CC(C)[N@@H+](Cc1nc(-c2ccc(Br)cc2)c[nH]1)C[C@H]1CCC(=O)N1 ZINC000414565601 565950208 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566001209 /nfs/dbraw/zinc/00/12/09/566001209.db2.gz LVJSTNOBKNTOTQ-APWZRJJASA-N 1 1 389.293 3.390 10 0 GGAEMO Cc1cc(Br)oc1C(=O)NCC1(N2CCCCC2)CC[NH+](C)CC1 ZINC000363341907 566001841 /nfs/dbraw/zinc/00/18/41/566001841.db2.gz SURHMWOKZUVJHF-UHFFFAOYSA-N 1 1 398.345 3.031 10 0 GGAEMO C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1ccc(OC(F)F)c(Br)c1 ZINC000179720036 566002622 /nfs/dbraw/zinc/00/26/22/566002622.db2.gz RFLXHKOCEMXALA-GXSJLCMTSA-N 1 1 377.229 3.136 10 0 GGAEMO C[C@H]1C[N@@H+](CC2=Cc3cc(Cl)cc(Cl)c3OC2)C[C@H]1N1CCOCC1 ZINC000245728483 566002555 /nfs/dbraw/zinc/00/25/55/566002555.db2.gz JDWNKPHQDZBLHM-SCLBCKFNSA-N 1 1 383.319 3.422 10 0 GGAEMO O[C@@]12CCCC[C@H]1C[N@@H+](Cc1cc(Br)c3c(c1)OCCO3)CC2 ZINC000245725189 566002758 /nfs/dbraw/zinc/00/27/58/566002758.db2.gz IRVVNVSYQSBMRS-KBXCAEBGSA-N 1 1 382.298 3.347 10 0 GGAEMO CC[C@H]1C[N@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)CCN1CC(F)F ZINC000245746372 566004154 /nfs/dbraw/zinc/00/41/54/566004154.db2.gz MXQQOTWORCWPSJ-UONOGXRCSA-N 1 1 397.293 3.394 10 0 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1 1 379.810 3.278 10 0 GGAEMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1C(=O)Nc1cc(C(F)(F)F)ccc1Cl ZINC000416718388 566104032 /nfs/dbraw/zinc/10/40/32/566104032.db2.gz CEZMWNOGKJBWFU-GHMZBOCLSA-N 1 1 379.810 3.278 10 0 GGAEMO OC[C@@H]1C[N@@H+](Cc2cc3c(c(Br)c2)OCO3)C[C@H]1c1ccsc1 ZINC000249570416 566105000 /nfs/dbraw/zinc/10/50/00/566105000.db2.gz OBJXLOVYFFAXJP-KBPBESRZSA-N 1 1 396.306 3.447 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2ccc(CC(F)(F)F)cc2)[C@@H](C)C1 ZINC000249635259 566105745 /nfs/dbraw/zinc/10/57/45/566105745.db2.gz RRRBGXFLTXJICJ-BBRMVZONSA-N 1 1 378.460 3.142 10 0 GGAEMO CC[N@H+]1CCC[C@H](NC(=O)N[C@H](C)c2ccc(OC)c(Br)c2)C1 ZINC000249758014 566107590 /nfs/dbraw/zinc/10/75/90/566107590.db2.gz IYHFZDDHIBMDSM-OCCSQVGLSA-N 1 1 384.318 3.302 10 0 GGAEMO CO[C@@H]1C[N@H+]([C@H](C)C(=O)N(C)Cc2ccc(Br)cc2)CC[C@@H]1C ZINC000251518176 566110384 /nfs/dbraw/zinc/11/03/84/566110384.db2.gz CMOLDTPNTRFKPD-JJRVBVJISA-N 1 1 383.330 3.153 10 0 GGAEMO C[C@H](Oc1ccc(F)cc1Br)C(=O)NCC[N@H+]1CCCC[C@H]1C ZINC000251615082 566111844 /nfs/dbraw/zinc/11/18/44/566111844.db2.gz CHMGZRWXUDBWFG-OLZOCXBDSA-N 1 1 387.293 3.346 10 0 GGAEMO C[C@@H]1CN(C(=O)Nc2ccc(Br)c(Cl)c2)[C@@H](C)C[N@H+]1CCO ZINC000416941688 566114200 /nfs/dbraw/zinc/11/42/00/566114200.db2.gz IJPOMYJRKPPLHL-MNOVXSKESA-N 1 1 390.709 3.021 10 0 GGAEMO CC(C)c1cc(Br)ccc1NC(=O)N1C[C@H](C)[N@@H+](CCO)C[C@H]1C ZINC000416969015 566116709 /nfs/dbraw/zinc/11/67/09/566116709.db2.gz ZRXOXGYIBPUSSI-UONOGXRCSA-N 1 1 398.345 3.491 10 0 GGAEMO CCOc1c(Cl)cc(NC(=O)N2C[C@@H](C)[N@@H+](CCO)C[C@@H]2C)cc1Cl ZINC000416995657 566118103 /nfs/dbraw/zinc/11/81/03/566118103.db2.gz LQGCBMYWCCXXJZ-NEPJUHHUSA-N 1 1 390.311 3.311 10 0 GGAEMO CCOc1c(Cl)cc(NC(=O)N2C[C@@H](C)[N@@H+](CCO)C[C@H]2C)cc1Cl ZINC000416995660 566118466 /nfs/dbraw/zinc/11/84/66/566118466.db2.gz LQGCBMYWCCXXJZ-VXGBXAGGSA-N 1 1 390.311 3.311 10 0 GGAEMO C[C@@H]1C[N@H+](CCO)[C@@H](C)CN1C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1 ZINC000417012603 566119117 /nfs/dbraw/zinc/11/91/17/566119117.db2.gz XKKPBGDHUWYQLH-WDEREUQCSA-N 1 1 379.810 3.278 10 0 GGAEMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)Nc1cc(Cl)cc(C(F)(F)F)c1 ZINC000417012603 566119122 /nfs/dbraw/zinc/11/91/22/566119122.db2.gz XKKPBGDHUWYQLH-WDEREUQCSA-N 1 1 379.810 3.278 10 0 GGAEMO O=C(N[C@H](CO)c1cccc(Br)c1)[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000181143022 566119407 /nfs/dbraw/zinc/11/94/07/566119407.db2.gz MWEGOILANDSCOK-CRAIPNDOSA-N 1 1 395.341 3.253 10 0 GGAEMO CN(Cc1ccc(Br)cc1)C[C@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000261414526 566124104 /nfs/dbraw/zinc/12/41/04/566124104.db2.gz UIDQMYBAYCQPBX-LJQANCHMSA-N 1 1 377.326 3.374 10 0 GGAEMO CN(Cc1ccccc1)C[C@@H](O)C[N@H+](C)Cc1ccc(Br)cc1 ZINC000261414526 566124107 /nfs/dbraw/zinc/12/41/07/566124107.db2.gz UIDQMYBAYCQPBX-LJQANCHMSA-N 1 1 377.326 3.374 10 0 GGAEMO CN(Cc1ccccc1)C[C@@H](O)C[N@@H+](C)Cc1ccc(Br)cc1 ZINC000261414526 566124111 /nfs/dbraw/zinc/12/41/11/566124111.db2.gz UIDQMYBAYCQPBX-LJQANCHMSA-N 1 1 377.326 3.374 10 0 GGAEMO C[C@@H]1C[N@H+](CCO)[C@@H](C)CN1C(=O)Nc1cccc(Br)c1Cl ZINC000417106011 566124580 /nfs/dbraw/zinc/12/45/80/566124580.db2.gz FUMAPPPQJQJDQM-WDEREUQCSA-N 1 1 390.709 3.021 10 0 GGAEMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1C(=O)Nc1cccc(Br)c1Cl ZINC000417106011 566124581 /nfs/dbraw/zinc/12/45/81/566124581.db2.gz FUMAPPPQJQJDQM-WDEREUQCSA-N 1 1 390.709 3.021 10 0 GGAEMO Cc1[nH+]cc2n1CC[C@H](C(=O)N[C@@H](C)Cc1ccc(Br)cc1)C2 ZINC000289507988 566125850 /nfs/dbraw/zinc/12/58/50/566125850.db2.gz MRVOMHOQIFGKNJ-WFASDCNBSA-N 1 1 376.298 3.264 10 0 GGAEMO Cc1[nH+]cc2n1CC[C@@H](C(=O)N[C@H](C)Cc1ccc(Br)cc1)C2 ZINC000289507984 566126521 /nfs/dbraw/zinc/12/65/21/566126521.db2.gz MRVOMHOQIFGKNJ-IUODEOHRSA-N 1 1 376.298 3.264 10 0 GGAEMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1csc(Br)c1 ZINC000261622904 566126675 /nfs/dbraw/zinc/12/66/75/566126675.db2.gz ALMKBDVLRZTYGK-CYBMUJFWSA-N 1 1 381.295 3.306 10 0 GGAEMO Cc1nc2n(n1)CCC[C@@H]2[NH2+][C@H](C)CC(=O)Nc1ccc(Br)cc1 ZINC000181255634 566128307 /nfs/dbraw/zinc/12/83/07/566128307.db2.gz KTWBMUOXPCGNFL-ABAIWWIYSA-N 1 1 392.301 3.191 10 0 GGAEMO Cc1nc2n(n1)CCC[C@H]2[NH2+][C@H](C)CC(=O)Nc1ccc(Br)cc1 ZINC000181255653 566128534 /nfs/dbraw/zinc/12/85/34/566128534.db2.gz KTWBMUOXPCGNFL-IAQYHMDHSA-N 1 1 392.301 3.191 10 0 GGAEMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1ccc(Br)s1 ZINC000261676380 566128707 /nfs/dbraw/zinc/12/87/07/566128707.db2.gz BRJXICREAOSTBL-GFCCVEGCSA-N 1 1 381.295 3.306 10 0 GGAEMO Cc1nc2n(n1)CCC[C@H]2[NH2+][C@@H](C)c1ccc(I)cc1 ZINC000181257864 566128656 /nfs/dbraw/zinc/12/86/56/566128656.db2.gz MZQRRMVFORMORL-IINYFYTJSA-N 1 1 382.249 3.377 10 0 GGAEMO Cc1nc2n(n1)CCC[C@H]2[NH2+][C@@H](C)CC(=O)Nc1ccc(Br)cc1 ZINC000181255618 566128728 /nfs/dbraw/zinc/12/87/28/566128728.db2.gz KTWBMUOXPCGNFL-XHDPSFHLSA-N 1 1 392.301 3.191 10 0 GGAEMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)Cc1ccc(Br)s1 ZINC000261690969 566129477 /nfs/dbraw/zinc/12/94/77/566129477.db2.gz CHOUFFDZQSJUOA-AWEZNQCLSA-N 1 1 395.322 3.235 10 0 GGAEMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1cccc(Br)c1 ZINC000261705086 566130334 /nfs/dbraw/zinc/13/03/34/566130334.db2.gz DFKJRUFOECXLDM-INIZCTEOSA-N 1 1 375.266 3.244 10 0 GGAEMO C[C@@H]1CCC[C@@H](C)[NH+]1CCNC(=O)[C@@](C)(N)c1ccc(Br)cc1 ZINC000261702333 566130916 /nfs/dbraw/zinc/13/09/16/566130916.db2.gz IOFLMCLZTWJKTR-LBTNJELSSA-N 1 1 382.346 3.002 10 0 GGAEMO C[C@]1(CN2CCC(C(=O)Nc3cccc(Br)c3)CC2)CC[NH2+]C1 ZINC000261732936 566131860 /nfs/dbraw/zinc/13/18/60/566131860.db2.gz HJODUNYRAVEKHA-SFHVURJKSA-N 1 1 380.330 3.099 10 0 GGAEMO C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC000261738774 566132155 /nfs/dbraw/zinc/13/21/55/566132155.db2.gz MMBTUCGSCCCBFW-YVEFUNNKSA-N 1 1 380.275 3.329 10 0 GGAEMO C[C@@]1(CN2CCC(C(=O)Nc3cccc(Br)c3)CC2)CC[NH2+]C1 ZINC000261732932 566132369 /nfs/dbraw/zinc/13/23/69/566132369.db2.gz HJODUNYRAVEKHA-GOSISDBHSA-N 1 1 380.330 3.099 10 0 GGAEMO Cn1cc([C@@H]2C[NH2+]CCN2C(=O)[C@@H]2C[C@@H]2c2ccc(Cl)cc2Cl)cn1 ZINC000181323280 566132954 /nfs/dbraw/zinc/13/29/54/566132954.db2.gz ANOPOIPVJIXFDQ-INMHGKMJSA-N 1 1 379.291 3.004 10 0 GGAEMO Cn1cc([C@H]2C[NH2+]CCN2C(=O)CCCSc2ccc(Cl)cc2)cn1 ZINC000181344531 566134176 /nfs/dbraw/zinc/13/41/76/566134176.db2.gz VYOMQUNLQSXHJD-QGZVFWFLSA-N 1 1 378.929 3.119 10 0 GGAEMO Cn1ccnc1[C@@H]1C[NH2+]CCN1C(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000261803288 566134671 /nfs/dbraw/zinc/13/46/71/566134671.db2.gz VXWXLWCXSYDTIT-WWGRRREGSA-N 1 1 379.291 3.004 10 0 GGAEMO Cn1cc([C@@H]2C[NH2+]CCN2C(=O)CCCc2cc(Cl)sc2Cl)cn1 ZINC000181359190 566134984 /nfs/dbraw/zinc/13/49/84/566134984.db2.gz SPYHWGFAWSOLLR-ZDUSSCGKSA-N 1 1 387.336 3.284 10 0 GGAEMO Cn1cc([C@H]2C[NH2+]CCN2C(=O)CCCc2cc(Cl)sc2Cl)cn1 ZINC000181359211 566135072 /nfs/dbraw/zinc/13/50/72/566135072.db2.gz SPYHWGFAWSOLLR-CYBMUJFWSA-N 1 1 387.336 3.284 10 0 GGAEMO CCN(CC)CC[NH+]1CCC(C(=O)Nc2ccccc2Br)CC1 ZINC000181374169 566137089 /nfs/dbraw/zinc/13/70/89/566137089.db2.gz NNUVVOAISCMFAF-UHFFFAOYSA-N 1 1 382.346 3.441 10 0 GGAEMO CCOC(=O)c1csc(C2CC[NH+](Cc3cnc([C@H](C)O)s3)CC2)n1 ZINC000289733772 566137494 /nfs/dbraw/zinc/13/74/94/566137494.db2.gz OZAIEGPNJSWYCZ-NSHDSACASA-N 1 1 381.523 3.209 10 0 GGAEMO Cc1cc(C[C@H](C)[NH2+][C@@H](C)CC(=O)Nc2cccc(Br)c2)n[nH]1 ZINC000181424143 566139674 /nfs/dbraw/zinc/13/96/74/566139674.db2.gz HSQRGGMMVUESCO-RYUDHWBXSA-N 1 1 379.302 3.419 10 0 GGAEMO Cc1cc(C[C@@H](C)[NH2+][C@@H](C)CC(=O)Nc2cccc(Br)c2)n[nH]1 ZINC000181424121 566139790 /nfs/dbraw/zinc/13/97/90/566139790.db2.gz HSQRGGMMVUESCO-NEPJUHHUSA-N 1 1 379.302 3.419 10 0 GGAEMO Cc1cc(C[C@H](C)[NH2+][C@H](C)CC(=O)Nc2cccc(Br)c2)n[nH]1 ZINC000181424179 566139835 /nfs/dbraw/zinc/13/98/35/566139835.db2.gz HSQRGGMMVUESCO-NWDGAFQWSA-N 1 1 379.302 3.419 10 0 GGAEMO Cc1cc(C[C@H](C)[NH2+][C@H](C)CC(=O)Nc2ccc(Br)cc2)n[nH]1 ZINC000181423799 566139871 /nfs/dbraw/zinc/13/98/71/566139871.db2.gz OFQHFKZSRDLOHC-NWDGAFQWSA-N 1 1 379.302 3.419 10 0 GGAEMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1sccc1Br ZINC000261913815 566139992 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COC(=O)CC[N@H+](Cc1cccc(Br)c1)C[C@H](O)CC(F)(F)F ZINC000484305487 566425232 /nfs/dbraw/zinc/42/52/32/566425232.db2.gz VIRPVAAEQSOOGO-CYBMUJFWSA-N 1 1 398.219 3.128 10 0 GGAEMO COc1cc(C[NH+]2CCN(c3ccc(Br)cn3)CC2)ccc1C ZINC000447746736 566426204 /nfs/dbraw/zinc/42/62/04/566426204.db2.gz QJMPXBPGKADVDK-UHFFFAOYSA-N 1 1 376.298 3.483 10 0 GGAEMO NC(=O)C[C@@H]1CCCC[N@H+]1Cc1ccc(OC(F)F)c(Br)c1 ZINC000537165103 566427319 /nfs/dbraw/zinc/42/73/19/566427319.db2.gz HZQGGWGCZZZQGS-NSHDSACASA-N 1 1 377.229 3.280 10 0 GGAEMO O=S(=O)(NCCC[N@H+]1CCc2ccccc2C1)c1c(F)cccc1Cl ZINC000463694782 566427555 /nfs/dbraw/zinc/42/75/55/566427555.db2.gz FBLNNVOBDCFWCA-UHFFFAOYSA-N 1 1 382.888 3.206 10 0 GGAEMO NC(=O)[C@@H]1CCC[N@H+]1CCCNC(=O)Nc1cc(Cl)c(Cl)c(Cl)c1 ZINC000626597790 566428340 /nfs/dbraw/zinc/42/83/40/566428340.db2.gz FSZRMRGPIGQZAO-LBPRGKRZSA-N 1 1 393.702 3.108 10 0 GGAEMO C[N@@H+](CC(=O)NC1(c2ccccc2Br)CCC1)[C@@H]1CCSC1 ZINC000650165480 566429598 /nfs/dbraw/zinc/42/95/98/566429598.db2.gz 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LDFPPABLNOIQNC-KRDRHDLTSA-N 1 1 389.337 3.468 10 0 GGAEMO CNS(=O)(=O)CCC[N@@H+](C)[C@@H]1CCC[C@@H]1c1ccc(C(F)(F)F)cc1 ZINC000537375234 566441657 /nfs/dbraw/zinc/44/16/57/566441657.db2.gz LUTXZORASGZKJT-HZPDHXFCSA-N 1 1 378.460 3.213 10 0 GGAEMO COc1cccc(OC)c1C[NH2+]Cc1cc(Br)c(O)c(OC)c1 ZINC000671708168 566443362 /nfs/dbraw/zinc/44/33/62/566443362.db2.gz NDKWTLHRCBPXPG-UHFFFAOYSA-N 1 1 382.254 3.470 10 0 GGAEMO C[C@@](CO)([NH2+]Cc1cn2cccc(F)c2n1)c1ccc(Br)cc1 ZINC000671725737 566445672 /nfs/dbraw/zinc/44/56/72/566445672.db2.gz UDSSSVMLCXZLLQ-KRWDZBQOSA-N 1 1 378.245 3.233 10 0 GGAEMO Cc1nnc([C@H]2CCC[N@@H+](C[C@H](O)COc3c(Cl)cccc3Cl)C2)[nH]1 ZINC000537562220 566452380 /nfs/dbraw/zinc/45/23/80/566452380.db2.gz MARYLLDHMGKWCZ-STQMWFEESA-N 1 1 385.295 3.039 10 0 GGAEMO Cc1n[nH]c([C@H]2CCC[N@H+](C[C@H](O)COc3c(Cl)cccc3Cl)C2)n1 ZINC000537562220 566452385 /nfs/dbraw/zinc/45/23/85/566452385.db2.gz MARYLLDHMGKWCZ-STQMWFEESA-N 1 1 385.295 3.039 10 0 GGAEMO Cc1n[nH]c([C@H]2CCC[N@@H+](C[C@H](O)COc3c(Cl)cccc3Cl)C2)n1 ZINC000537562220 566452391 /nfs/dbraw/zinc/45/23/91/566452391.db2.gz MARYLLDHMGKWCZ-STQMWFEESA-N 1 1 385.295 3.039 10 0 GGAEMO Cc1nc([C@H]2CCC[N@H+](C[C@H](O)COc3c(Cl)cccc3Cl)C2)n[nH]1 ZINC000537562220 566452397 /nfs/dbraw/zinc/45/23/97/566452397.db2.gz MARYLLDHMGKWCZ-STQMWFEESA-N 1 1 385.295 3.039 10 0 GGAEMO Cc1nc([C@H]2CCC[N@@H+](C[C@H](O)COc3c(Cl)cccc3Cl)C2)n[nH]1 ZINC000537562220 566452401 /nfs/dbraw/zinc/45/24/01/566452401.db2.gz MARYLLDHMGKWCZ-STQMWFEESA-N 1 1 385.295 3.039 10 0 GGAEMO CC(C)Cc1ncc(C[NH2+]Cc2cccc(S(=O)(=O)NC(C)C)c2)s1 ZINC000448060293 566454934 /nfs/dbraw/zinc/45/49/34/566454934.db2.gz JYGADLKAPBDOFF-UHFFFAOYSA-N 1 1 381.567 3.318 10 0 GGAEMO CS(=O)(=O)N[C@H]1CC[N@H+](Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)C1 ZINC000537634669 566457211 /nfs/dbraw/zinc/45/72/11/566457211.db2.gz PRUIIPJMPGVQTM-LBPRGKRZSA-N 1 1 389.304 3.377 10 0 GGAEMO CS(=O)(=O)N[C@H]1CC[N@@H+](Cc2ccc(-c3ccc(Cl)c(Cl)c3)o2)C1 ZINC000537634669 566457217 /nfs/dbraw/zinc/45/72/17/566457217.db2.gz PRUIIPJMPGVQTM-LBPRGKRZSA-N 1 1 389.304 3.377 10 0 GGAEMO CN(C(=O)NCc1cc(F)c(F)cc1Br)[C@H]1CC[N@H+](C2CC2)C1 ZINC000511384931 566459350 /nfs/dbraw/zinc/45/93/50/566459350.db2.gz VTYZZHKTLMIQPE-LBPRGKRZSA-N 1 1 388.256 3.105 10 0 GGAEMO C[C@H](NC(=O)C(=O)c1ccc(Br)cc1)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000511381440 566459373 /nfs/dbraw/zinc/45/93/73/566459373.db2.gz RKLSMXHCXZBITR-DZGCQCFKSA-N 1 1 393.325 3.401 10 0 GGAEMO NC(=O)c1c(F)cc(Br)cc1N[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000537641014 566459874 /nfs/dbraw/zinc/45/98/74/566459874.db2.gz HUPZDBATRABDEQ-AWEZNQCLSA-N 1 1 392.272 3.374 10 0 GGAEMO CN(C)C[C@@H](NC(=O)NC[C@]1(C)CCC[NH2+]C1)c1ccc(Cl)c(Cl)c1 ZINC000627085798 566463292 /nfs/dbraw/zinc/46/32/92/566463292.db2.gz WLVZJRPELKNMRI-SJLPKXTDSA-N 1 1 387.355 3.285 10 0 GGAEMO CN(C)C[C@H](NC(=O)NCC1(C)CC[NH2+]CC1)c1ccc(Cl)c(Cl)c1 ZINC000627084514 566463896 /nfs/dbraw/zinc/46/38/96/566463896.db2.gz UWCROCAAIWNEMY-INIZCTEOSA-N 1 1 387.355 3.285 10 0 GGAEMO CN(C)C[C@H](NC(=O)NCCC[C@H]1CCC[NH2+]1)c1ccc(Cl)c(Cl)c1 ZINC000627101250 566464814 /nfs/dbraw/zinc/46/48/14/566464814.db2.gz UDPYMKYKBHLXHA-PBHICJAKSA-N 1 1 387.355 3.428 10 0 GGAEMO CN(C)C[C@@H](NC(=O)NCCC1=CC[NH2+]CC1)c1ccc(Cl)c(Cl)c1 ZINC000627090462 566465433 /nfs/dbraw/zinc/46/54/33/566465433.db2.gz VFHRYEURTSSVGX-QGZVFWFLSA-N 1 1 385.339 3.205 10 0 GGAEMO FC(F)Oc1c(Cl)cc(Cl)cc1C[NH2+][C@@H](C1CC1)[C@@H]1CNCCO1 ZINC000422876880 566465471 /nfs/dbraw/zinc/46/54/71/566465471.db2.gz QVXSFRBIJGVUNW-KBPBESRZSA-N 1 1 381.250 3.451 10 0 GGAEMO O=C(NC[C@@H]1CCCC[N@H+]1CCO)c1cnc(-c2ccccc2Cl)s1 ZINC000650596507 566465805 /nfs/dbraw/zinc/46/58/05/566465805.db2.gz FFYPMRCWTCJFNL-ZDUSSCGKSA-N 1 1 379.913 3.040 10 0 GGAEMO O=C(NC[C@@H]1CCCC[N@@H+]1CCO)c1cnc(-c2ccccc2Cl)s1 ZINC000650596507 566465812 /nfs/dbraw/zinc/46/58/12/566465812.db2.gz FFYPMRCWTCJFNL-ZDUSSCGKSA-N 1 1 379.913 3.040 10 0 GGAEMO CNS(=O)(=O)C[C@@H]1CCC[N@H+]1C/C(C)=C\c1cccc(C(F)(F)F)c1 ZINC000558400562 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CC[N@H+]1CCCC[C@H]1CNC(=O)Cc1noc2ccc(Br)cc21 ZINC000424666719 566555233 /nfs/dbraw/zinc/55/52/33/566555233.db2.gz PQEXGJIPAMRJRM-ZDUSSCGKSA-N 1 1 380.286 3.123 10 0 GGAEMO Cn1ccc(C[NH2+][C@@H]2CCCOc3ccc(I)cc32)n1 ZINC000539044485 566555642 /nfs/dbraw/zinc/55/56/42/566555642.db2.gz NGFHUUUJULUYPM-CQSZACIVSA-N 1 1 383.233 3.028 10 0 GGAEMO C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000486084598 566556264 /nfs/dbraw/zinc/55/62/64/566556264.db2.gz CTRGODSAHVTGFN-IUODEOHRSA-N 1 1 398.320 3.397 10 0 GGAEMO C[C@H](Cc1ccc(F)c(Br)c1)NC(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000486084595 566556437 /nfs/dbraw/zinc/55/64/37/566556437.db2.gz CTRGODSAHVTGFN-DOMZBBRYSA-N 1 1 398.320 3.397 10 0 GGAEMO COc1cc(OC)c(C[NH2+][C@H](CO)c2cccc(Br)c2)cc1F ZINC000651732467 566556580 /nfs/dbraw/zinc/55/65/80/566556580.db2.gz WBDWPASBTADTIG-OAHLLOKOSA-N 1 1 384.245 3.429 10 0 GGAEMO Cn1cc(C[N@H+]2CC[C@H](Cc3cccc(I)c3)C2)cn1 ZINC000449395355 566556702 /nfs/dbraw/zinc/55/67/02/566556702.db2.gz 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/nfs/dbraw/zinc/57/08/68/566570868.db2.gz PGDRROAGCKWEGH-XJKSGUPXSA-N 1 1 396.329 3.095 10 0 GGAEMO CO[C@@H]1CC[N@@H+](CCCOc2cccc(I)c2)C[C@H]1C ZINC000449506414 566571778 /nfs/dbraw/zinc/57/17/78/566571778.db2.gz SIHTVQORNHQRKC-CZUORRHYSA-N 1 1 389.277 3.417 10 0 GGAEMO CO[C@H]1CC[N@@H+](CCCOc2cccc(I)c2)C[C@@H]1C ZINC000449506412 566571880 /nfs/dbraw/zinc/57/18/80/566571880.db2.gz SIHTVQORNHQRKC-BBRMVZONSA-N 1 1 389.277 3.417 10 0 GGAEMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000651897176 566573103 /nfs/dbraw/zinc/57/31/03/566573103.db2.gz QPFXXFUMUACWSY-HZPDHXFCSA-N 1 1 393.325 3.448 10 0 GGAEMO C[C@H](CC(=O)Nc1ccc(F)cc1)[NH2+][C@@H](C)c1ncc(Br)cn1 ZINC000559861686 566573340 /nfs/dbraw/zinc/57/33/40/566573340.db2.gz AYUVDDIBOPKLJL-MNOVXSKESA-N 1 1 381.249 3.446 10 0 GGAEMO COc1ccc(NC(=O)C[C@@H](C)[NH2+][C@@H](C)c2ncc(Br)cn2)cc1 ZINC000559862634 566573371 /nfs/dbraw/zinc/57/33/71/566573371.db2.gz FVTRDJIFTVRZDQ-NEPJUHHUSA-N 1 1 393.285 3.316 10 0 GGAEMO CC1(C)CCC[N@@H+](CCNC(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000424809026 566573696 /nfs/dbraw/zinc/57/36/96/566573696.db2.gz LUMHFGGXQFHECV-UHFFFAOYSA-N 1 1 394.313 3.371 10 0 GGAEMO CC(C)[C@H](C[NH2+][C@H](C)Cn1cc(Br)ccc1=O)N1CCC(C)CC1 ZINC000559894303 566574722 /nfs/dbraw/zinc/57/47/22/566574722.db2.gz PMDLTQKAYWUTRH-AEFFLSMTSA-N 1 1 398.389 3.345 10 0 GGAEMO CCCCCc1nnc(NC(=O)C[NH2+][C@@H](CO)c2ccc(Cl)cc2)s1 ZINC000579046120 566575063 /nfs/dbraw/zinc/57/50/63/566575063.db2.gz DSEQKGBOKCRZCC-AWEZNQCLSA-N 1 1 382.917 3.186 10 0 GGAEMO CCCC[N@@H+](C)C[C@@H](C)NC(=O)Cc1noc2ccc(Br)cc21 ZINC000424822641 566575048 /nfs/dbraw/zinc/57/50/48/566575048.db2.gz GRKSOGBOHWWPTN-GFCCVEGCSA-N 1 1 382.302 3.369 10 0 GGAEMO CC[N@H+]1CC[C@@H](CNC(=O)c2ccc(Br)c(OC(F)(F)F)c2)C1 ZINC000513057945 566575784 /nfs/dbraw/zinc/57/57/84/566575784.db2.gz IRPREFCGXIYPQJ-JTQLQIEISA-N 1 1 395.219 3.419 10 0 GGAEMO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ncc(Br)cc2F)[C@H]1n1cccn1 ZINC000559923395 566576309 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COC(=O)c1ccc(C(=O)NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)s1 ZINC000610180618 566811728 /nfs/dbraw/zinc/81/17/28/566811728.db2.gz HRIWTCGPEOKXTE-WBMJQRKESA-N 1 1 378.519 3.409 10 0 GGAEMO O=C1CCCN1[C@@H]1CCCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000517222312 566812409 /nfs/dbraw/zinc/81/24/09/566812409.db2.gz WOFMOESSIWFUGL-CQSZACIVSA-N 1 1 391.313 3.302 10 0 GGAEMO O=C1CCCN1[C@@H]1CCC[N@@H+](Cc2nc3cc(Br)ccc3[nH]2)CC1 ZINC000517222312 566812413 /nfs/dbraw/zinc/81/24/13/566812413.db2.gz WOFMOESSIWFUGL-CQSZACIVSA-N 1 1 391.313 3.302 10 0 GGAEMO O=C1CCCN1[C@@H]1CCC[N@H+](Cc2nc3cc(Br)ccc3[nH]2)CC1 ZINC000517222312 566812419 /nfs/dbraw/zinc/81/24/19/566812419.db2.gz WOFMOESSIWFUGL-CQSZACIVSA-N 1 1 391.313 3.302 10 0 GGAEMO COC(=O)c1ccc(C(=O)NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)s1 ZINC000610180617 566812617 /nfs/dbraw/zinc/81/26/17/566812617.db2.gz HRIWTCGPEOKXTE-LRDDRELGSA-N 1 1 378.519 3.409 10 0 GGAEMO C[C@H]([NH2+]C[C@@H](O)CC(F)(F)F)c1nc(-c2ccc(Br)cc2)no1 ZINC000469776964 566812689 /nfs/dbraw/zinc/81/26/89/566812689.db2.gz UHIJHQLWGUFJDF-KWQFWETISA-N 1 1 394.191 3.463 10 0 GGAEMO C[C@H]([NH2+]C[C@H](O)CC(F)(F)F)c1nc(-c2ccc(Br)cc2)no1 ZINC000469776960 566812703 /nfs/dbraw/zinc/81/27/03/566812703.db2.gz UHIJHQLWGUFJDF-GZMMTYOYSA-N 1 1 394.191 3.463 10 0 GGAEMO C[C@@H]([NH2+]CC(=O)N1CCOC[C@@H]1C1CC1)c1cc(F)c(Cl)cc1Cl ZINC000678729086 566815091 /nfs/dbraw/zinc/81/50/91/566815091.db2.gz WYCCWKAEHOWOES-QLJPJBMISA-N 1 1 375.271 3.421 10 0 GGAEMO CC(=O)N[C@H](CC1CCC1)C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000469807571 566815480 /nfs/dbraw/zinc/81/54/80/566815480.db2.gz NVZCPSAZOFRYFB-QGZVFWFLSA-N 1 1 396.329 3.144 10 0 GGAEMO COC(=O)c1ccc(Br)cc1C[N@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451415700 566815766 /nfs/dbraw/zinc/81/57/66/566815766.db2.gz FTGRPVHAUBZMDI-BRWVUGGUSA-N 1 1 382.298 3.361 10 0 GGAEMO C[N@H+]1CCC[C@H](CNC(=O)c2ccc([S@](C)=O)cc2)[C@@H]1c1cccs1 ZINC000610200281 566815716 /nfs/dbraw/zinc/81/57/16/566815716.db2.gz WZCGYANDERJUIQ-JTJQLJSMSA-N 1 1 376.547 3.298 10 0 GGAEMO C[N@H+]1CCC[C@H](CNC(=O)c2ccc([S@](C)=O)cc2)[C@H]1c1cccs1 ZINC000610200279 566815745 /nfs/dbraw/zinc/81/57/45/566815745.db2.gz WZCGYANDERJUIQ-DZQNVJDRSA-N 1 1 376.547 3.298 10 0 GGAEMO CC[C@@H]([NH2+]Cc1ccc(Br)cc1N1CCOCC1)c1ccn(C)n1 ZINC000542667227 566816480 /nfs/dbraw/zinc/81/64/80/566816480.db2.gz GKFSTOBALBUCGE-MRXNPFEDSA-N 1 1 393.329 3.260 10 0 GGAEMO CC[C@H]1C[N@@H+](C)CCCN1S(=O)(=O)Cc1cccc(Br)c1C ZINC000655580780 566816478 /nfs/dbraw/zinc/81/64/78/566816478.db2.gz FXLZFVYULQLNMD-HNNXBMFYSA-N 1 1 389.359 3.003 10 0 GGAEMO O=C(C[N@H+]1CC[C@](O)(C(F)F)C1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000451423505 566817827 /nfs/dbraw/zinc/81/78/27/566817827.db2.gz FEUARIHKWXGPJU-RHSMWYFYSA-N 1 1 393.261 3.359 10 0 GGAEMO O=C(C[N@@H+]1CC[C@](O)(C(F)F)C1)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000451423505 566817829 /nfs/dbraw/zinc/81/78/29/566817829.db2.gz FEUARIHKWXGPJU-RHSMWYFYSA-N 1 1 393.261 3.359 10 0 GGAEMO Brc1ccc(-c2ncc(C[N@@H+]3CCN4CCOC[C@H]4C3)s2)cc1 ZINC000542691420 566818358 /nfs/dbraw/zinc/81/83/58/566818358.db2.gz SRAQQHWNGIEZFA-OAHLLOKOSA-N 1 1 394.338 3.089 10 0 GGAEMO Brc1ccc(-c2ncc(C[N@H+]3CCN4CCOC[C@H]4C3)s2)cc1 ZINC000542691420 566818360 /nfs/dbraw/zinc/81/83/60/566818360.db2.gz SRAQQHWNGIEZFA-OAHLLOKOSA-N 1 1 394.338 3.089 10 0 GGAEMO C[C@H]([NH2+]Cc1c(Cl)cccc1OC(F)F)c1ccc(S(N)(=O)=O)cc1 ZINC000631772276 566823456 /nfs/dbraw/zinc/82/34/56/566823456.db2.gz ASSPZMINZZPOFK-JTQLQIEISA-N 1 1 390.839 3.440 10 0 GGAEMO CN(C)c1nccc(C[NH2+][C@H]2CCCOc3ccc(Br)cc32)n1 ZINC000678927521 566825074 /nfs/dbraw/zinc/82/50/74/566825074.db2.gz OUVNDVPKPQLRPT-HNNXBMFYSA-N 1 1 377.286 3.309 10 0 GGAEMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@@H]1CCCN(S(=O)(=O)c2onc(C3CC3)c2Cl)C1 ZINC000631785163 566825861 /nfs/dbraw/zinc/82/58/61/566825861.db2.gz MFAPHMIUXZLUJK-MBNYWOFBSA-N 1 1 387.933 3.231 10 0 GGAEMO COCC[N@@H+](Cc1ccnc(-c2ccc(Br)cc2)n1)[C@H]1CCOC1 ZINC000490047092 566827306 /nfs/dbraw/zinc/82/73/06/566827306.db2.gz JFZOQORDDSXGIS-KRWDZBQOSA-N 1 1 392.297 3.143 10 0 GGAEMO COCC[N@@H+](CCOc1ccc(Cl)cc1Br)[C@@H]1CCOC1 ZINC000490059023 566827594 /nfs/dbraw/zinc/82/75/94/566827594.db2.gz VNMZBRPUDGNRRH-CYBMUJFWSA-N 1 1 378.694 3.219 10 0 GGAEMO COCC[N@H+](Cc1cc(Br)ccc1OC(F)F)[C@@H]1CCOC1 ZINC000490042414 566827872 /nfs/dbraw/zinc/82/78/72/566827872.db2.gz IUTAIDRWMWEIPW-CYBMUJFWSA-N 1 1 380.229 3.288 10 0 GGAEMO COCC[N@@H+](Cc1cc(Br)ccc1OC(F)F)[C@@H]1CCOC1 ZINC000490042414 566827876 /nfs/dbraw/zinc/82/78/76/566827876.db2.gz IUTAIDRWMWEIPW-CYBMUJFWSA-N 1 1 380.229 3.288 10 0 GGAEMO Cn1ccc(C[N@@H+]2CCC[C@H]2c2ccc(I)cc2)cc1=O ZINC000610372007 566828159 /nfs/dbraw/zinc/82/81/59/566828159.db2.gz DNQUSZBTBJDOPL-INIZCTEOSA-N 1 1 394.256 3.327 10 0 GGAEMO Cn1ccc(C[N@H+]2CCC[C@H]2c2ccc(I)cc2)cc1=O ZINC000610372007 566828160 /nfs/dbraw/zinc/82/81/60/566828160.db2.gz DNQUSZBTBJDOPL-INIZCTEOSA-N 1 1 394.256 3.327 10 0 GGAEMO CC[NH+]1CCN(c2ccccc2NC(=O)C(=O)c2ccc(Cl)s2)CC1 ZINC000428342787 566832139 /nfs/dbraw/zinc/83/21/39/566832139.db2.gz YNPSXMIDWJYNHS-UHFFFAOYSA-N 1 1 377.897 3.365 10 0 GGAEMO C[C@]1(F)C[NH2+]CCN(C(=O)CCCSc2ccc(Br)cc2)C1 ZINC000517564535 566833105 /nfs/dbraw/zinc/83/31/05/566833105.db2.gz DPDYPIJFHGVLGK-INIZCTEOSA-N 1 1 389.334 3.481 10 0 GGAEMO CCCN([C@@H]1CCC[N@H+](Cc2ccccc2)C1)S(=O)(=O)c1cscn1 ZINC000582119202 566833125 /nfs/dbraw/zinc/83/31/25/566833125.db2.gz LSEURBNRUKVNPY-QGZVFWFLSA-N 1 1 379.551 3.208 10 0 GGAEMO CCCN([C@@H]1CCC[N@@H+](Cc2ccccc2)C1)S(=O)(=O)c1cscn1 ZINC000582119202 566833132 /nfs/dbraw/zinc/83/31/32/566833132.db2.gz LSEURBNRUKVNPY-QGZVFWFLSA-N 1 1 379.551 3.208 10 0 GGAEMO C[N@@H+](CC(=O)N1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1)[C@@H]1CCSC1 ZINC000490182808 566835088 /nfs/dbraw/zinc/83/50/88/566835088.db2.gz RKKSQORXZSHEKP-CJNGLKHVSA-N 1 1 378.929 3.317 10 0 GGAEMO C[N@H+](CC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)[C@@H]1CCSC1 ZINC000490182808 566835093 /nfs/dbraw/zinc/83/50/93/566835093.db2.gz RKKSQORXZSHEKP-CJNGLKHVSA-N 1 1 378.929 3.317 10 0 GGAEMO C[N@@H+](CC(=O)N1CCC[C@H]1c1nc2ccc(Cl)cc2[nH]1)[C@@H]1CCSC1 ZINC000490182808 566835100 /nfs/dbraw/zinc/83/51/00/566835100.db2.gz RKKSQORXZSHEKP-CJNGLKHVSA-N 1 1 378.929 3.317 10 0 GGAEMO CCC[N@@H+](C)[C@H](CNS(=O)(=O)[C@@H]1CCO[C@@H](C)C1)c1ccc(Cl)cc1 ZINC000451540686 566836292 /nfs/dbraw/zinc/83/62/92/566836292.db2.gz ZMTWKFTXJKZJTK-BMGDILEWSA-N 1 1 388.961 3.210 10 0 GGAEMO C[NH+](C)[C@H](C(=O)Nc1cc(I)ccc1O)c1ccccc1 ZINC000610490905 566837170 /nfs/dbraw/zinc/83/71/70/566837170.db2.gz MCKXVEPLPOYZDG-HNNXBMFYSA-N 1 1 396.228 3.238 10 0 GGAEMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2csc(CCC(F)(F)F)n2)C1 ZINC000631951222 566837336 /nfs/dbraw/zinc/83/73/36/566837336.db2.gz ZOFVLYPPPKJCCL-TZMCWYRMSA-N 1 1 375.460 3.123 10 0 GGAEMO C[C@@H](c1ccccc1)N(C)C(=O)C[NH2+][C@@H](CO)c1cccc(Br)c1 ZINC000542912502 566837790 /nfs/dbraw/zinc/83/77/90/566837790.db2.gz ZIFCBIMMBAKSRY-KSSFIOAISA-N 1 1 391.309 3.292 10 0 GGAEMO Cc1ccc(NC(=O)C[NH2+][C@H](CO)c2cccc(Br)c2)cc1F ZINC000542911964 566838002 /nfs/dbraw/zinc/83/80/02/566838002.db2.gz QZLZMYZIJRBQLN-MRXNPFEDSA-N 1 1 381.245 3.158 10 0 GGAEMO Cc1ccc(NC(=O)C[NH2+][C@@H](CO)c2cccc(Br)c2)c(F)c1 ZINC000542910967 566838016 /nfs/dbraw/zinc/83/80/16/566838016.db2.gz QRCHZKBVIMTCQM-INIZCTEOSA-N 1 1 381.245 3.158 10 0 GGAEMO Cc1cccc(NC(=O)C2CC[NH+](Cc3nccn3C)CC2)c1Br ZINC000470048583 566840347 /nfs/dbraw/zinc/84/03/47/566840347.db2.gz UYABSOFQWUZKRT-UHFFFAOYSA-N 1 1 391.313 3.342 10 0 GGAEMO Cc1nc(S(=O)(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c(-c2ccccc2)s1 ZINC000632026754 566841766 /nfs/dbraw/zinc/84/17/66/566841766.db2.gz LLOLEPYZASFFNU-XJKSGUPXSA-N 1 1 379.551 3.222 10 0 GGAEMO C[C@@H]1C[C@H](NS(=O)(=O)c2ccc(C(F)(F)C(F)(F)F)cc2)CC[N@H+]1C ZINC000632030408 566843238 /nfs/dbraw/zinc/84/32/38/566843238.db2.gz RLUSNHAEPVNNTJ-ZYHUDNBSSA-N 1 1 386.386 3.102 10 0 GGAEMO O=C(CCNC1CC([NH+]2CCCCC2)C1)Nc1cccc(Br)c1 ZINC000563002287 566844453 /nfs/dbraw/zinc/84/44/53/566844453.db2.gz FZDCWNGVFCQFNX-UHFFFAOYSA-N 1 1 380.330 3.384 10 0 GGAEMO COc1cc(Br)ccc1C[NH2+]C1CCN(C[C@H]2CCCO2)CC1 ZINC000655755576 566845721 /nfs/dbraw/zinc/84/57/21/566845721.db2.gz FMBSUXCOMBLYKD-QGZVFWFLSA-N 1 1 383.330 3.191 10 0 GGAEMO Brc1cccc2c1OCC[C@@H]2NC1CC[NH+]([C@H]2CCOC2)CC1 ZINC000655763545 566845788 /nfs/dbraw/zinc/84/57/88/566845788.db2.gz PRSILKIXACWSJJ-YOEHRIQHSA-N 1 1 381.314 3.116 10 0 GGAEMO COc1cc(Br)ccc1[C@@H](C)NC1CC[NH+]([C@H]2CCOC2)CC1 ZINC000655757750 566845931 /nfs/dbraw/zinc/84/59/31/566845931.db2.gz KQIXVLNLYPWJCQ-CJNGLKHVSA-N 1 1 383.330 3.362 10 0 GGAEMO C[C@@H](Cc1[nH]cc[nH+]1)OCCCOc1cccc(I)c1 ZINC000543030278 566846628 /nfs/dbraw/zinc/84/66/28/566846628.db2.gz KBGJJHWDDXEVNT-LBPRGKRZSA-N 1 1 386.233 3.431 10 0 GGAEMO Cc1nn(-c2ccccc2Br)cc1C[NH2+][C@@H]1CCc2[nH]cnc2C1 ZINC000655775632 566846599 /nfs/dbraw/zinc/84/65/99/566846599.db2.gz AWEUCLRQGBDKEU-CQSZACIVSA-N 1 1 386.297 3.313 10 0 GGAEMO C[N@H+]1CCC[C@@H](NC(=O)c2coc(-c3ccc(Br)cc3F)n2)C1 ZINC000679302712 566846856 /nfs/dbraw/zinc/84/68/56/566846856.db2.gz FVSBXSWXMKLYQI-LLVKDONJSA-N 1 1 382.233 3.067 10 0 GGAEMO Cc1nn(-c2cccc(Br)c2)cc1C[NH2+][C@H]1CCc2[nH]cnc2C1 ZINC000655776949 566847929 /nfs/dbraw/zinc/84/79/29/566847929.db2.gz NKRNFEDNGQEMRT-HNNXBMFYSA-N 1 1 386.297 3.313 10 0 GGAEMO Fc1cc(Br)cc(OCC[N@@H+]2CCO[C@]3(CCSC3)C2)c1 ZINC000563067068 566850246 /nfs/dbraw/zinc/85/02/46/566850246.db2.gz CXEPFSWBHQJWMD-OAHLLOKOSA-N 1 1 376.291 3.175 10 0 GGAEMO Fc1cc(Br)cc(OCC[N@H+]2CCO[C@]3(CCSC3)C2)c1 ZINC000563067068 566850257 /nfs/dbraw/zinc/85/02/57/566850257.db2.gz CXEPFSWBHQJWMD-OAHLLOKOSA-N 1 1 376.291 3.175 10 0 GGAEMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000563064772 566851268 /nfs/dbraw/zinc/85/12/68/566851268.db2.gz WFXQVCGPIKVQDH-DOMZBBRYSA-N 1 1 382.302 3.008 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000470166478 566853700 /nfs/dbraw/zinc/85/37/00/566853700.db2.gz VMTHRFKVRVDAJF-MRXNPFEDSA-N 1 1 381.314 3.133 10 0 GGAEMO NC(=O)N[C@@H]1CC[N@@H+](Cc2ccc(Oc3cccc(Br)c3)cc2)C1 ZINC000470174899 566854282 /nfs/dbraw/zinc/85/42/82/566854282.db2.gz NQLDTHZNFNVASR-OAHLLOKOSA-N 1 1 390.281 3.484 10 0 GGAEMO C[N@H+]1CC[C@H](NC(=O)c2c(F)cncc2Br)[C@H]1c1ccccc1 ZINC000632159627 566856811 /nfs/dbraw/zinc/85/68/11/566856811.db2.gz JAVUZJJZALQDIC-GOEBONIOSA-N 1 1 378.245 3.158 10 0 GGAEMO C[N@H+]1CC[C@@H](NC(=O)c2c(F)cncc2Br)[C@@H]1c1ccccc1 ZINC000632159629 566856866 /nfs/dbraw/zinc/85/68/66/566856866.db2.gz JAVUZJJZALQDIC-ZBFHGGJFSA-N 1 1 378.245 3.158 10 0 GGAEMO C[N@H+]1CC[C@H](NC(=O)c2c(F)cncc2Br)[C@@H]1c1ccccc1 ZINC000632159628 566856985 /nfs/dbraw/zinc/85/69/85/566856985.db2.gz JAVUZJJZALQDIC-HOCLYGCPSA-N 1 1 378.245 3.158 10 0 GGAEMO C[N@H+]1CCC[C@H](NC(=O)Nc2ccc(Cl)cc2I)C1 ZINC000610767965 566861272 /nfs/dbraw/zinc/86/12/72/566861272.db2.gz IYXZVXHPSLKIKZ-JTQLQIEISA-N 1 1 393.656 3.160 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)NCC[N@H+]1CCCC(C)(C)C1 ZINC000470299517 566861820 /nfs/dbraw/zinc/86/18/20/566861820.db2.gz UUEGJZFQHUBAPP-UHFFFAOYSA-N 1 1 383.330 3.238 10 0 GGAEMO COc1ccccc1[C@@H]([NH3+])C(=O)N[C@H](C)c1ccc(Br)cc1OC ZINC000563161224 566862311 /nfs/dbraw/zinc/86/23/11/566862311.db2.gz UXMQHKCPTSLVGT-PIGZYNQJSA-N 1 1 393.281 3.344 10 0 GGAEMO COC(=O)[C@@H](c1cc(Cl)cc(Cl)c1)N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000610787112 566863992 /nfs/dbraw/zinc/86/39/92/566863992.db2.gz YZTUWBUEDUAHFA-IAGOWNOFSA-N 1 1 387.307 3.004 10 0 GGAEMO COC(=O)[C@H](c1cc(Cl)cc(Cl)c1)N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000610787114 566864228 /nfs/dbraw/zinc/86/42/28/566864228.db2.gz YZTUWBUEDUAHFA-SJORKVTESA-N 1 1 387.307 3.004 10 0 GGAEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNS(=O)(=O)Cc1cccc(C(F)(F)F)c1 ZINC000518088754 566865728 /nfs/dbraw/zinc/86/57/28/566865728.db2.gz ATPDFQVWHZJLOD-OKILXGFUSA-N 1 1 378.460 3.388 10 0 GGAEMO Cc1c(Br)cccc1CNC(=O)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000582496646 566867078 /nfs/dbraw/zinc/86/70/78/566867078.db2.gz HVJXAGCCSVTZMF-KRWDZBQOSA-N 1 1 389.297 3.009 10 0 GGAEMO C[NH+](C)[C@@H](CNC(=O)N1CCC[C@@H](OC(F)F)C1)c1ccccc1Cl ZINC000679680811 566868003 /nfs/dbraw/zinc/86/80/03/566868003.db2.gz WBSLCWJWDSIYNN-DOMZBBRYSA-N 1 1 375.847 3.356 10 0 GGAEMO C[NH+](C)[C@H](CNC(=O)N1CCC[C@@H](OC(F)F)C1)c1ccccc1Cl ZINC000679680812 566868104 /nfs/dbraw/zinc/86/81/04/566868104.db2.gz WBSLCWJWDSIYNN-IUODEOHRSA-N 1 1 375.847 3.356 10 0 GGAEMO O=C(CC[N@@H+]1CCC[C@H](OC(F)F)C1)Nc1ccc(Br)cc1 ZINC000679682892 566868285 /nfs/dbraw/zinc/86/82/85/566868285.db2.gz LDMHCLCXKLVTAO-ZDUSSCGKSA-N 1 1 377.229 3.481 10 0 GGAEMO O=C(CC[N@@H+]1CCC[C@@H](OC(F)F)C1)Nc1ccc(Br)cc1 ZINC000679682891 566868639 /nfs/dbraw/zinc/86/86/39/566868639.db2.gz LDMHCLCXKLVTAO-CYBMUJFWSA-N 1 1 377.229 3.481 10 0 GGAEMO Cc1ccc(CNS(=O)(=O)c2cccc(Cl)c2C)c(N2CCCC2)[nH+]1 ZINC000679712637 566869764 /nfs/dbraw/zinc/86/97/64/566869764.db2.gz LSAKZUWVQDWMBA-UHFFFAOYSA-N 1 1 379.913 3.431 10 0 GGAEMO COc1cc(Br)ccc1C[NH2+][C@H]1CCN(C2CCCCC2)C1=O ZINC000679771693 566872923 /nfs/dbraw/zinc/87/29/23/566872923.db2.gz JNNIOTMGPPJEJZ-INIZCTEOSA-N 1 1 381.314 3.481 10 0 GGAEMO NC(=O)[C@H]([NH2+]C[C@@H]1CCC2(CCCC2)O1)c1ccc(Br)cc1F ZINC000656129713 566873186 /nfs/dbraw/zinc/87/31/86/566873186.db2.gz MPZRHYYSDNDDGD-SWLSCSKDSA-N 1 1 385.277 3.196 10 0 GGAEMO O=C(NCc1cccc(Cl)c1Cl)NC1CCC([NH+]2CCNCC2)CC1 ZINC000582557994 566874374 /nfs/dbraw/zinc/87/43/74/566874374.db2.gz ZXXGSSICVFVTTL-UHFFFAOYSA-N 1 1 385.339 3.009 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)c2nnc(-c3ccc(Br)cc3)n2C)[C@@H](C)C1 ZINC000518261646 566874419 /nfs/dbraw/zinc/87/44/19/566874419.db2.gz NAXIOFJAHSFPHT-XJKSGUPXSA-N 1 1 392.345 3.411 10 0 GGAEMO CC[C@H]1C[N@@H+](CCCC(=O)Nc2c(C)cc(Br)cc2C)C[C@@H]1O ZINC000679821290 566874427 /nfs/dbraw/zinc/87/44/27/566874427.db2.gz IOOJLTDHJPQMMN-HOCLYGCPSA-N 1 1 383.330 3.487 10 0 GGAEMO CNC(=O)[C@H](C)C[N@@H+](C)CCCC(=O)Nc1c(C)cc(Br)cc1C ZINC000679817706 566874729 /nfs/dbraw/zinc/87/47/29/566874729.db2.gz BDFQNZIZQRTTIT-CQSZACIVSA-N 1 1 398.345 3.099 10 0 GGAEMO CC[C@@H]1C[N@@H+](CCCC(=O)Nc2c(C)cc(Br)cc2C)C[C@@H]1O ZINC000679821291 566874831 /nfs/dbraw/zinc/87/48/31/566874831.db2.gz IOOJLTDHJPQMMN-ZBFHGGJFSA-N 1 1 383.330 3.487 10 0 GGAEMO CCN1CC[NH+](CCCC(=O)Nc2c(C)cc(Br)cc2C)CC1 ZINC000679817146 566875159 /nfs/dbraw/zinc/87/51/59/566875159.db2.gz LPBUKBMJUNLYMM-UHFFFAOYSA-N 1 1 382.346 3.422 10 0 GGAEMO COc1c(C)cccc1C[NH2+]CCS(=O)(=O)c1cccc(Br)c1 ZINC000656154365 566875878 /nfs/dbraw/zinc/87/58/78/566875878.db2.gz WLWISHWXVLPERW-UHFFFAOYSA-N 1 1 398.322 3.330 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(S(=O)(=O)c2cscc2Br)CC1 ZINC000632327536 566876099 /nfs/dbraw/zinc/87/60/99/566876099.db2.gz ZFUXGNAIJUGFSL-UHFFFAOYSA-N 1 1 390.328 3.041 10 0 GGAEMO OC[C@]1(NCc2ncc(Br)s2)CCC[N@H+](Cc2ccccc2)C1 ZINC000679847456 566878069 /nfs/dbraw/zinc/87/80/69/566878069.db2.gz OZZVECIZECPLNH-KRWDZBQOSA-N 1 1 396.354 3.022 10 0 GGAEMO OC[C@]1(NCc2ncc(Br)s2)CCC[N@@H+](Cc2ccccc2)C1 ZINC000679847456 566878076 /nfs/dbraw/zinc/87/80/76/566878076.db2.gz OZZVECIZECPLNH-KRWDZBQOSA-N 1 1 396.354 3.022 10 0 GGAEMO OC[C@]1([NH2+]Cc2ncc(Br)s2)CCCN(Cc2ccccc2)C1 ZINC000679847456 566878081 /nfs/dbraw/zinc/87/80/81/566878081.db2.gz OZZVECIZECPLNH-KRWDZBQOSA-N 1 1 396.354 3.022 10 0 GGAEMO CC1(C)CCCN(c2cc[nH+]c(NCc3ccc(S(C)(=O)=O)s3)n2)C1 ZINC000656175383 566879953 /nfs/dbraw/zinc/87/99/53/566879953.db2.gz CZYIDZAQMYGSRQ-UHFFFAOYSA-N 1 1 380.539 3.180 10 0 GGAEMO COc1c(Br)cc(CNCCC[NH+]2CCC2)cc1Br ZINC000563417783 566881990 /nfs/dbraw/zinc/88/19/90/566881990.db2.gz MBKIBLHVYFMIFO-UHFFFAOYSA-N 1 1 392.135 3.406 10 0 GGAEMO CC[N@H+]1CC[C@H](CNC(=O)Nc2cc(C)cc(I)c2)C1 ZINC000490836430 566882323 /nfs/dbraw/zinc/88/23/23/566882323.db2.gz XBHYCVOKEXROHC-GFCCVEGCSA-N 1 1 387.265 3.063 10 0 GGAEMO COc1ccc(Br)c2[nH]c(C(=O)N(C)[C@H]3CC[N@H+](C4CC4)C3)cc21 ZINC000518428814 566882619 /nfs/dbraw/zinc/88/26/19/566882619.db2.gz XYOQLGZFHCNTTG-LBPRGKRZSA-N 1 1 392.297 3.248 10 0 GGAEMO COC(=O)C[C@](C)([NH2+]Cc1snnc1C)c1ccc(Br)cc1 ZINC000582670229 566884021 /nfs/dbraw/zinc/88/40/21/566884021.db2.gz RSUFLFVUFHZNQO-HNNXBMFYSA-N 1 1 384.299 3.177 10 0 GGAEMO CN(Cc1ccccc1Br)C(=O)C[N@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000543483128 566885849 /nfs/dbraw/zinc/88/58/49/566885849.db2.gz IGOADJNFPZBSDI-NVXWUHKLSA-N 1 1 397.357 3.136 10 0 GGAEMO CS(=O)(=O)CC[C@@H]1CCCC[N@H+]1CCc1cccc(OC(F)(F)F)c1 ZINC000428859726 566886848 /nfs/dbraw/zinc/88/68/48/566886848.db2.gz DAPBASZEUXIZIL-HNNXBMFYSA-N 1 1 379.444 3.417 10 0 GGAEMO Cc1[nH+]cc2n1C[C@H](C(=O)Nc1ccc(CN(C)C)c(Br)c1)CC2 ZINC000582729262 566889276 /nfs/dbraw/zinc/88/92/76/566889276.db2.gz IWMAGUZITXTVCH-CQSZACIVSA-N 1 1 391.313 3.217 10 0 GGAEMO COC(=O)C[C@@](C)([NH2+]Cc1cc(C)ncn1)c1ccc(Br)cc1 ZINC000428944174 566891812 /nfs/dbraw/zinc/89/18/12/566891812.db2.gz RZFUGIKQDKUMIM-QGZVFWFLSA-N 1 1 378.270 3.116 10 0 GGAEMO Cc1nn(-c2cccc(Br)c2)cc1CN1CC[C@H]2C[N@H+](C)C[C@@H]21 ZINC000656260054 566892450 /nfs/dbraw/zinc/89/24/50/566892450.db2.gz IHLWLLPJHPTWLX-KSSFIOAISA-N 1 1 375.314 3.079 10 0 GGAEMO Cc1cc(Br)cc(C)c1CNC(=O)N[C@@H]1C[C@@H](C)[N@H+](C2CC2)C1 ZINC000428969418 566893599 /nfs/dbraw/zinc/89/35/99/566893599.db2.gz RKJHAOCOOWXASG-UKRRQHHQSA-N 1 1 380.330 3.490 10 0 GGAEMO C[C@H](C(=O)Nc1ccc(I)cc1)[N@@H+]1CC[C@@H](C(F)F)C1 ZINC000611179758 566896259 /nfs/dbraw/zinc/89/62/59/566896259.db2.gz JCEIEPKVNAGLKE-NXEZZACHSA-N 1 1 394.203 3.205 10 0 GGAEMO C[C@H](C(=O)Nc1ccc(I)cc1)[N@H+]1CC[C@@H](C(F)F)C1 ZINC000611179758 566896262 /nfs/dbraw/zinc/89/62/62/566896262.db2.gz JCEIEPKVNAGLKE-NXEZZACHSA-N 1 1 394.203 3.205 10 0 GGAEMO C[C@H](C(=O)Nc1ccc(I)cc1)[N@@H+]1CC[C@H](C(F)F)C1 ZINC000611179761 566896680 /nfs/dbraw/zinc/89/66/80/566896680.db2.gz JCEIEPKVNAGLKE-ZJUUUORDSA-N 1 1 394.203 3.205 10 0 GGAEMO C[C@H](C(=O)Nc1ccc(I)cc1)[N@H+]1CC[C@H](C(F)F)C1 ZINC000611179761 566896681 /nfs/dbraw/zinc/89/66/81/566896681.db2.gz JCEIEPKVNAGLKE-ZJUUUORDSA-N 1 1 394.203 3.205 10 0 GGAEMO C[C@@H](C(=O)Nc1ccc(I)cc1)[N@@H+]1CC[C@H](C(F)F)C1 ZINC000611179759 566896772 /nfs/dbraw/zinc/89/67/72/566896772.db2.gz JCEIEPKVNAGLKE-UWVGGRQHSA-N 1 1 394.203 3.205 10 0 GGAEMO C[C@@H](C(=O)Nc1ccc(I)cc1)[N@H+]1CC[C@H](C(F)F)C1 ZINC000611179759 566896781 /nfs/dbraw/zinc/89/67/81/566896781.db2.gz JCEIEPKVNAGLKE-UWVGGRQHSA-N 1 1 394.203 3.205 10 0 GGAEMO CC(C)Sc1cc(Br)ccc1CN1CC[N@H+]2C[C@H](O)C[C@H]2C1 ZINC000656273879 566897693 /nfs/dbraw/zinc/89/76/93/566897693.db2.gz RBBYYGAFLUXEDM-JKSUJKDBSA-N 1 1 385.371 3.200 10 0 GGAEMO C[N@@H+](CC1CC1)C[C@@H]1CCN(C(=O)NCCc2ccccc2Br)C1 ZINC000470719410 566897821 /nfs/dbraw/zinc/89/78/21/566897821.db2.gz GJELCXRFMHARGA-INIZCTEOSA-N 1 1 394.357 3.365 10 0 GGAEMO Brc1ccc(C2([NH2+]Cc3cn(CC4CC4)nn3)CCOCC2)cc1 ZINC000518689770 566898054 /nfs/dbraw/zinc/89/80/54/566898054.db2.gz XGVWFJUEWQIBNR-UHFFFAOYSA-N 1 1 391.313 3.246 10 0 GGAEMO C[C@@H]1CN(CC(F)(F)F)CC[N@@H+](CCC(=O)Nc2ccccc2Cl)C1 ZINC000451876044 566898360 /nfs/dbraw/zinc/89/83/60/566898360.db2.gz XIXGZXPOEXRBBD-ZDUSSCGKSA-N 1 1 377.838 3.485 10 0 GGAEMO CN(Cc1ccc(Cl)c(Cl)c1)C(=O)C[N@@H+]1CC[C@@H]([C@H](O)C(F)(F)F)C1 ZINC000451881904 566901195 /nfs/dbraw/zinc/90/11/95/566901195.db2.gz BKUDNSAUJHWOCP-ABAIWWIYSA-N 1 1 399.240 3.197 10 0 GGAEMO CN(Cc1ccc(Cl)c(Cl)c1)C(=O)C[N@H+]1CC[C@@H]([C@H](O)C(F)(F)F)C1 ZINC000451881904 566901200 /nfs/dbraw/zinc/90/12/00/566901200.db2.gz BKUDNSAUJHWOCP-ABAIWWIYSA-N 1 1 399.240 3.197 10 0 GGAEMO O[C@H]([C@@H]1CC[N@H+](Cc2nc3cc(Br)ccc3o2)C1)C(F)(F)F ZINC000451888094 566902403 /nfs/dbraw/zinc/90/24/03/566902403.db2.gz KNQKDIZORCRCKN-AMIZOPFISA-N 1 1 379.176 3.335 10 0 GGAEMO O[C@H]([C@@H]1CC[N@@H+](Cc2nc3cc(Br)ccc3o2)C1)C(F)(F)F ZINC000451888094 566902410 /nfs/dbraw/zinc/90/24/10/566902410.db2.gz KNQKDIZORCRCKN-AMIZOPFISA-N 1 1 379.176 3.335 10 0 GGAEMO O[C@@H]([C@H]1CC[N@H+](Cc2nc3ccc(Br)cc3o2)C1)C(F)(F)F ZINC000451892313 566903381 /nfs/dbraw/zinc/90/33/81/566903381.db2.gz PCCUOCVSBQBNEG-SDBXPKJASA-N 1 1 379.176 3.335 10 0 GGAEMO O[C@@H]([C@H]1CC[N@@H+](Cc2nc3ccc(Br)cc3o2)C1)C(F)(F)F ZINC000451892313 566903382 /nfs/dbraw/zinc/90/33/82/566903382.db2.gz PCCUOCVSBQBNEG-SDBXPKJASA-N 1 1 379.176 3.335 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2cc(OC)c(Br)cn2)[C@H](C)C1 ZINC000680368051 566904085 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GGAEMO C[C@H]([NH2+]Cc1ccc(S(C)(=O)=O)s1)c1cc(-c2ccccc2)nn1C ZINC000453218364 567065721 /nfs/dbraw/zinc/06/57/21/567065721.db2.gz KTNFEXKUASAFAO-ZDUSSCGKSA-N 1 1 375.519 3.403 10 0 GGAEMO Cc1cc(NC(=O)[C@H](C)[NH2+][C@@H](CO)c2ccsc2)ccc1Br ZINC000473165872 567065939 /nfs/dbraw/zinc/06/59/39/567065939.db2.gz GSOQYVDQZSFMDP-NHYWBVRUSA-N 1 1 383.311 3.469 10 0 GGAEMO C[C@H](C(=O)N1CCSc2ccccc21)[N@@H+]1CCSC2(CCOCC2)C1 ZINC000473196834 567066979 /nfs/dbraw/zinc/06/69/79/567066979.db2.gz CASNVGFVUYMFKR-OAHLLOKOSA-N 1 1 378.563 3.112 10 0 GGAEMO C[C@H](C(=O)N1CCSc2ccccc21)[N@H+]1CCSC2(CCOCC2)C1 ZINC000473196834 567066988 /nfs/dbraw/zinc/06/69/88/567066988.db2.gz CASNVGFVUYMFKR-OAHLLOKOSA-N 1 1 378.563 3.112 10 0 GGAEMO CC(=O)NCc1ccc(C[NH2+]Cc2cc3c(cc2Br)OCO3)cc1 ZINC000657541621 567067786 /nfs/dbraw/zinc/06/77/86/567067786.db2.gz QLZVEKPICQULIQ-UHFFFAOYSA-N 1 1 391.265 3.104 10 0 GGAEMO Brc1cncc(Br)c1C[NH2+][C@H]1COC2(CCC2)C1 ZINC000657630576 567078145 /nfs/dbraw/zinc/07/81/45/567078145.db2.gz 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CCCOc1ccc(Br)cc1C[NH2+][C@H]1CC[C@@H](C)S(=O)(=O)C1 ZINC000657634655 567078884 /nfs/dbraw/zinc/07/88/84/567078884.db2.gz KCWXEQYDDFSBQZ-DOMZBBRYSA-N 1 1 390.343 3.293 10 0 GGAEMO CN1CC[C@H]([NH2+]C[C@H](CO)Cc2cc(Br)ccc2F)[C@H]2CCC[C@H]21 ZINC000453367423 567079562 /nfs/dbraw/zinc/07/95/62/567079562.db2.gz MMFZCPKHVCFETQ-VLDUQVBPSA-N 1 1 399.348 3.202 10 0 GGAEMO Cc1cc(Br)c(C[NH2+][C@@H]2CC[C@@H](C)S(=O)(=O)C2)cc1Cl ZINC000657640028 567080805 /nfs/dbraw/zinc/08/08/05/567080805.db2.gz UUXSLEPIUGHHRL-ZYHUDNBSSA-N 1 1 380.735 3.466 10 0 GGAEMO O=C(CCc1cccc(F)c1Br)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614088509 567082248 /nfs/dbraw/zinc/08/22/48/567082248.db2.gz CIFATMUFXKKKAO-LSDHHAIUSA-N 1 1 387.268 3.166 10 0 GGAEMO O=C(N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1)C1(Cc2ccccc2Br)CC1 ZINC000614088265 567082499 /nfs/dbraw/zinc/08/24/99/567082499.db2.gz ARLFBCRHTGCQMD-DLBZAZTESA-N 1 1 395.316 3.417 10 0 GGAEMO Cc1ccc(C(=O)N[C@@H]2CCCC[C@@H]2[NH+]2CCOCC2)c(C)c1Br ZINC000682919834 567082711 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10 0 GGAEMO O=C(c1ccc(Br)c(Cl)c1F)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614098122 567084295 /nfs/dbraw/zinc/08/42/95/567084295.db2.gz PRFAKUNCSZIXJU-NEPJUHHUSA-N 1 1 393.659 3.500 10 0 GGAEMO O=C(Cc1cc(Cl)ccc1Br)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614096210 567084343 /nfs/dbraw/zinc/08/43/43/567084343.db2.gz XMNIYRWLLJDQNX-HUUCEWRRSA-N 1 1 389.696 3.290 10 0 GGAEMO O=C(Cc1ccc(Br)c(Cl)c1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614091206 567084358 /nfs/dbraw/zinc/08/43/58/567084358.db2.gz CSTNSCSSCWYUDZ-LSDHHAIUSA-N 1 1 389.696 3.290 10 0 GGAEMO COc1cc(C)c(Br)cc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614099519 567084370 /nfs/dbraw/zinc/08/43/70/567084370.db2.gz WEGZDHIGJJNLKA-GJZGRUSLSA-N 1 1 385.277 3.024 10 0 GGAEMO O=C(Cc1c[nH]c2cc(Br)ccc12)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614092791 567084405 /nfs/dbraw/zinc/08/44/05/567084405.db2.gz GXTDQETXFXAKCP-WBVHZDCISA-N 1 1 394.288 3.118 10 0 GGAEMO O=C(c1cc(Cl)cc(Br)c1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614096223 567084486 /nfs/dbraw/zinc/08/44/86/567084486.db2.gz XPSNPEHOZFHVRP-UONOGXRCSA-N 1 1 375.669 3.361 10 0 GGAEMO C[C@H](CC(=O)NCc1c[nH+]c(N(C)C)n1C)c1ccc(Br)cc1 ZINC000431491840 567084648 /nfs/dbraw/zinc/08/46/48/567084648.db2.gz ZAKRDSGIPNWSRO-GFCCVEGCSA-N 1 1 379.302 3.059 10 0 GGAEMO CSc1cc(Cl)ccc1NC(=O)C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000657683023 567084630 /nfs/dbraw/zinc/08/46/30/567084630.db2.gz CBUUTDDXAXEDEP-AGUYFDCRSA-N 1 1 381.929 3.132 10 0 GGAEMO O=C(N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1)C1(c2ccccc2Br)CC1 ZINC000614095405 567084788 /nfs/dbraw/zinc/08/47/88/567084788.db2.gz XWOROUKEQBHDCF-HZPDHXFCSA-N 1 1 381.289 3.125 10 0 GGAEMO Cn1cc(C(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)c(-c2ccc(Cl)s2)n1 ZINC000614092818 567084861 /nfs/dbraw/zinc/08/48/61/567084861.db2.gz MELDXWQHSBFIDR-OLZOCXBDSA-N 1 1 382.892 3.060 10 0 GGAEMO Cc1ccc(CCC(=O)N2CC[C@@H]([NH+]3CCC3)[C@@H](F)C2)c(Br)c1 ZINC000614092750 567084913 /nfs/dbraw/zinc/08/49/13/567084913.db2.gz LUUOXSZXESPYCT-DLBZAZTESA-N 1 1 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O=C(c1cc2cc(Br)ccc2o1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000684184979 567187383 /nfs/dbraw/zinc/18/73/83/567187383.db2.gz IQBILFDXFLCSNP-ZIAGYGMSSA-N 1 1 381.245 3.454 10 0 GGAEMO CC[N@H+]1C[C@@H](C)N(C(=O)c2ccc(C)c(I)c2)C[C@@H]1C ZINC000498570882 567188954 /nfs/dbraw/zinc/18/89/54/567188954.db2.gz HVZZHORZYGJVHJ-QWHCGFSZSA-N 1 1 386.277 3.154 10 0 GGAEMO COc1cc(C[NH2+]Cc2nn(C)c3ccccc23)cc(Br)c1O ZINC000589650771 567190988 /nfs/dbraw/zinc/19/09/88/567190988.db2.gz LHHVDJBHQVQHNJ-UHFFFAOYSA-N 1 1 376.254 3.340 10 0 GGAEMO C[N@H+]1CC[C@H](C(=O)Nc2ccc(=O)n(Cc3ccc(Cl)c(Cl)c3)c2)C1 ZINC000524300546 567191604 /nfs/dbraw/zinc/19/16/04/567191604.db2.gz WTXOEGQCJXUVIG-ZDUSSCGKSA-N 1 1 380.275 3.094 10 0 GGAEMO COC(=O)CC(C)(C)CC(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000615577894 567191779 /nfs/dbraw/zinc/19/17/79/567191779.db2.gz QJTFWPNOFKDCNF-UHFFFAOYSA-N 1 1 385.302 3.429 10 0 GGAEMO O=C(NCCc1c(F)cccc1F)c1sc2c(c1Br)C[NH2+]C2 ZINC000659254688 567193455 /nfs/dbraw/zinc/19/34/55/567193455.db2.gz DSKCTXDZEOUFNA-UHFFFAOYSA-N 1 1 387.249 3.365 10 0 GGAEMO COc1cccc(C[C@@H](C)NC(=O)c2sc3c(c2Br)C[NH2+]C3)c1 ZINC000659248955 567193588 /nfs/dbraw/zinc/19/35/88/567193588.db2.gz JXUXWLUKIJUIJE-SNVBAGLBSA-N 1 1 395.322 3.483 10 0 GGAEMO CCC1(CC)[C@H](NC(=O)c2sc3c(c2Br)C[NH2+]C3)C[C@H]1OC ZINC000659245626 567193892 /nfs/dbraw/zinc/19/38/92/567193892.db2.gz ATSDUYLTJRDVIP-VXGBXAGGSA-N 1 1 387.343 3.437 10 0 GGAEMO COc1ccc(CCNC(=O)c2sc3c(c2Br)C[NH2+]C3)cc1 ZINC000659253068 567194190 /nfs/dbraw/zinc/19/41/90/567194190.db2.gz DQZCKMNYKCHZLL-UHFFFAOYSA-N 1 1 381.295 3.095 10 0 GGAEMO C[N@H+]1CCC[C@@H](NC(=O)N(Cc2cc(Br)ccc2F)C2CC2)C1 ZINC000589767878 567194211 /nfs/dbraw/zinc/19/42/11/567194211.db2.gz WTMVJCMWILXQDA-CQSZACIVSA-N 1 1 384.293 3.356 10 0 GGAEMO C[NH2+][C@@H](C(=O)N[C@@H](C)Cc1c(C)nn(C)c1C)c1cccc(Cl)c1Cl ZINC000659252383 567194348 /nfs/dbraw/zinc/19/43/48/567194348.db2.gz QFGSNHRKKQALRG-DYZYQPBXSA-N 1 1 383.323 3.352 10 0 GGAEMO CC(=O)Nc1cccc(CNC(=O)c2sc3c(c2Br)C[NH2+]C3)c1 ZINC000659246982 567194367 /nfs/dbraw/zinc/19/43/67/567194367.db2.gz HUCKKVXHCGNKNH-UHFFFAOYSA-N 1 1 394.294 3.002 10 0 GGAEMO CN(C(=O)c1sc2c(c1Br)C[NH2+]C2)C1Cc2ccccc2C1 ZINC000659251453 567194575 /nfs/dbraw/zinc/19/45/75/567194575.db2.gz GJYRIWVUZQFGFB-UHFFFAOYSA-N 1 1 377.307 3.353 10 0 GGAEMO COc1ccc(NC(=O)c2sc3c(c2Br)C[NH2+]C3)cc1OC ZINC000659253151 567194611 /nfs/dbraw/zinc/19/46/11/567194611.db2.gz HZNREMDDGMOQJE-UHFFFAOYSA-N 1 1 383.267 3.383 10 0 GGAEMO C[C@H](CNC(=O)c1sc2c(c1Br)C[NH2+]C2)Oc1cccc(F)c1 ZINC000659251661 567194636 /nfs/dbraw/zinc/19/46/36/567194636.db2.gz HAZHMZSOXSDGGS-SECBINFHSA-N 1 1 399.285 3.450 10 0 GGAEMO C[N@H+]1CC[C@]2(C1)CCCN(C(=O)CCc1cccc(F)c1Br)C2 ZINC000615607358 567194542 /nfs/dbraw/zinc/19/45/42/567194542.db2.gz SPYFIISLKKRPDL-SFHVURJKSA-N 1 1 383.305 3.465 10 0 GGAEMO Ic1cccc2ncnc(N[C@@H]3CC[N@H+]4CCCC[C@H]34)c12 ZINC000547277701 567195176 /nfs/dbraw/zinc/19/51/76/567195176.db2.gz WIYXPCRGILFDML-TZMCWYRMSA-N 1 1 394.260 3.273 10 0 GGAEMO CCO[C@H]1C[C@@H](N(C)C(=O)c2sc3c(c2Br)C[NH2+]C3)C1(C)C ZINC000659257488 567195598 /nfs/dbraw/zinc/19/55/98/567195598.db2.gz CVUMXZXSIAISMT-NEPJUHHUSA-N 1 1 387.343 3.389 10 0 GGAEMO COC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@@H+]1C[C@@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000615635348 567196059 /nfs/dbraw/zinc/19/60/59/567196059.db2.gz RIFQBYLPJUFMIX-RKCSVJPLSA-N 1 1 388.291 3.007 10 0 GGAEMO COC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1C[C@@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000615635348 567196069 /nfs/dbraw/zinc/19/60/69/567196069.db2.gz RIFQBYLPJUFMIX-RKCSVJPLSA-N 1 1 388.291 3.007 10 0 GGAEMO C[C@H]1CN(c2cc(C3CC3)nc3c(Br)cccc23)CC[N@H+]1CCO ZINC000432847715 567196142 /nfs/dbraw/zinc/19/61/42/567196142.db2.gz VYLNWLNUKMLGGT-ZDUSSCGKSA-N 1 1 390.325 3.378 10 0 GGAEMO O=C(NC[C@H]1CCOc2ccccc21)c1sc2c(c1Br)C[NH2+]C2 ZINC000659269388 567196276 /nfs/dbraw/zinc/19/62/76/567196276.db2.gz PIFRMDSLRRDOOZ-SNVBAGLBSA-N 1 1 393.306 3.410 10 0 GGAEMO CN(C[C@H]1CCC[N@@H+](C)C1)c1ncnc2cccc(I)c21 ZINC000547288097 567196323 /nfs/dbraw/zinc/19/63/23/567196323.db2.gz KQNJVLQMWKWHKB-LBPRGKRZSA-N 1 1 396.276 3.012 10 0 GGAEMO COC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@@H+]1C[C@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000615635336 567196351 /nfs/dbraw/zinc/19/63/51/567196351.db2.gz RIFQBYLPJUFMIX-DIGLBZAJSA-N 1 1 388.291 3.007 10 0 GGAEMO COC(=O)[C@@H]1[C@@H]2CCC[C@H]2C[N@H+]1C[C@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000615635336 567196356 /nfs/dbraw/zinc/19/63/56/567196356.db2.gz RIFQBYLPJUFMIX-DIGLBZAJSA-N 1 1 388.291 3.007 10 0 GGAEMO CN(C)C(=O)c1cccc(NC(=O)c2sc3c(c2Br)C[NH2+]C3)c1 ZINC000659268816 567196727 /nfs/dbraw/zinc/19/67/27/567196727.db2.gz SUTOAAQQZYWRMW-UHFFFAOYSA-N 1 1 394.294 3.068 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCc2ccccc2CC1 ZINC000659269204 567196753 /nfs/dbraw/zinc/19/67/53/567196753.db2.gz MLUFRPHJORQCKK-UHFFFAOYSA-N 1 1 377.307 3.355 10 0 GGAEMO COC[C@H](Cc1ccccc1)NC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659268136 567196869 /nfs/dbraw/zinc/19/68/69/567196869.db2.gz IXXGLZQNZFLIRA-LBPRGKRZSA-N 1 1 395.322 3.101 10 0 GGAEMO CCO[C@@H]1C[C@H](NC(=O)c2sc3c(c2Br)C[NH2+]C3)C12CCC2 ZINC000659268660 567196882 /nfs/dbraw/zinc/19/68/82/567196882.db2.gz RTHAUCUUKRMFPJ-NWDGAFQWSA-N 1 1 385.327 3.191 10 0 GGAEMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)c1c[nH]c3cccc(Br)c13)C2 ZINC000615611991 567196928 /nfs/dbraw/zinc/19/69/28/567196928.db2.gz NHFMRBOMBJSGPL-GOSISDBHSA-N 1 1 376.298 3.488 10 0 GGAEMO CCOc1ccccc1CNC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659265403 567196983 /nfs/dbraw/zinc/19/69/83/567196983.db2.gz YEDDXAOCQLWXCT-UHFFFAOYSA-N 1 1 381.295 3.443 10 0 GGAEMO CN(C[C@@H]1CCC[N@@H+](C)C1)c1ncnc2cccc(I)c21 ZINC000547288096 567197269 /nfs/dbraw/zinc/19/72/69/567197269.db2.gz KQNJVLQMWKWHKB-GFCCVEGCSA-N 1 1 396.276 3.012 10 0 GGAEMO C[C@H]1C[C@H](Nc2ncnc3cccc(I)c32)CC[N@H+]1C ZINC000547287441 567197300 /nfs/dbraw/zinc/19/73/00/567197300.db2.gz WMRKGEXXOKFAAR-WDEREUQCSA-N 1 1 382.249 3.129 10 0 GGAEMO CN1CCN(C(=O)c2sc3c(c2Br)C[NH2+]C3)c2ccccc21 ZINC000659277621 567197526 /nfs/dbraw/zinc/19/75/26/567197526.db2.gz AUSLGMUPZBIREQ-UHFFFAOYSA-N 1 1 378.295 3.210 10 0 GGAEMO COCCOc1ccc(NC(=O)c2sc3c(c2Br)C[NH2+]C3)cc1 ZINC000659273903 567198099 /nfs/dbraw/zinc/19/80/99/567198099.db2.gz MQOVRZORMAEYRS-UHFFFAOYSA-N 1 1 397.294 3.391 10 0 GGAEMO COCCOc1ccccc1NC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659272286 567198471 /nfs/dbraw/zinc/19/84/71/567198471.db2.gz XIVAWEOVLITHTP-UHFFFAOYSA-N 1 1 397.294 3.391 10 0 GGAEMO CC(C)[C@@H]1OCCC[C@H]1CNC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659277194 567198613 /nfs/dbraw/zinc/19/86/13/567198613.db2.gz YQQBOTYNSVKLIX-HZMBPMFUSA-N 1 1 387.343 3.295 10 0 GGAEMO O=C(NCCOc1ccc(F)cc1)c1sc2c(c1Br)C[NH2+]C2 ZINC000659272198 567198637 /nfs/dbraw/zinc/19/86/37/567198637.db2.gz XDWUOSJFHNGZDD-UHFFFAOYSA-N 1 1 385.258 3.062 10 0 GGAEMO CCO[C@@H](CCNC(=O)c1sc2c(c1Br)C[NH2+]C2)C(C)C ZINC000659282147 567198703 /nfs/dbraw/zinc/19/87/03/567198703.db2.gz NVGJZWINYOMARZ-NSHDSACASA-N 1 1 375.332 3.295 10 0 GGAEMO CO[C@]1(C)C[C@H](N(C)C(=O)c2sc3c(c2Br)C[NH2+]C3)C1(C)C ZINC000659278458 567198862 /nfs/dbraw/zinc/19/88/62/567198862.db2.gz FRICJYMEJWGVMA-MEDUHNTESA-N 1 1 387.343 3.389 10 0 GGAEMO C[C@@H](CNC(=O)c1sc2c(c1Br)CNC2)[N@H+]1CCCC[C@@H]1C ZINC000659292354 567199730 /nfs/dbraw/zinc/19/97/30/567199730.db2.gz OSDWOQLKBLYYNN-QWRGUYRKSA-N 1 1 386.359 3.107 10 0 GGAEMO CCc1cnc(CN(C)C(=O)c2sc3c(c2Br)C[NH2+]C3)s1 ZINC000659287709 567200717 /nfs/dbraw/zinc/20/07/17/567200717.db2.gz SSZAEUWVGBRRIF-UHFFFAOYSA-N 1 1 386.340 3.405 10 0 GGAEMO Cc1cc(C[C@H](C)[NH2+]Cc2c(F)ccc(I)c2F)n[nH]1 ZINC000474819048 567202282 /nfs/dbraw/zinc/20/22/82/567202282.db2.gz NHCGQCXTZHXPIY-QMMMGPOBSA-N 1 1 391.203 3.322 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCC[C@@H]1c1cccnc1 ZINC000659303316 567202560 /nfs/dbraw/zinc/20/25/60/567202560.db2.gz STDOBNFODHHXKY-GFCCVEGCSA-N 1 1 378.295 3.486 10 0 GGAEMO CC(C)C[C@@H]1C[C@H](NC(=O)c2sc3c(c2Br)C[NH2+]C3)CCO1 ZINC000659316388 567203523 /nfs/dbraw/zinc/20/35/23/567203523.db2.gz BZCZQYBZEJCBAI-GHMZBOCLSA-N 1 1 387.343 3.437 10 0 GGAEMO C[C@@H]1C[C@@H]1CNC(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000474838552 567203529 /nfs/dbraw/zinc/20/35/29/567203529.db2.gz SWVPKOMXQXCCTE-UKRRQHHQSA-N 1 1 380.330 3.369 10 0 GGAEMO C[C@@H]1C[C@H]1CNC(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000474838551 567203605 /nfs/dbraw/zinc/20/36/05/567203605.db2.gz SWVPKOMXQXCCTE-HIFRSBDPSA-N 1 1 380.330 3.369 10 0 GGAEMO O=C(NCCc1ccc(F)c(F)c1)c1sc2c(c1Br)C[NH2+]C2 ZINC000659306720 567203694 /nfs/dbraw/zinc/20/36/94/567203694.db2.gz HYSGRMYYHQSCCG-UHFFFAOYSA-N 1 1 387.249 3.365 10 0 GGAEMO CCC[N@@H+](CC)C[C@@H](C)NC(=O)NCc1ccc(Br)cc1OC ZINC000637501469 567204269 /nfs/dbraw/zinc/20/42/69/567204269.db2.gz ITSSNMPAEJLJOE-CYBMUJFWSA-N 1 1 386.334 3.377 10 0 GGAEMO Cc1cnc([C@@H](C)CNC(=O)c2sc3c(c2Br)C[NH2+]C3)s1 ZINC000659317625 567204274 /nfs/dbraw/zinc/20/42/74/567204274.db2.gz OKRPBKGDWKAZKM-ZETCQYMHSA-N 1 1 386.340 3.412 10 0 GGAEMO COc1ccc2c(c1)CN(C(=O)c1sc3c(c1Br)C[NH2+]C3)C2 ZINC000659331034 567205796 /nfs/dbraw/zinc/20/57/96/567205796.db2.gz YNVUMELIPFSXCJ-UHFFFAOYSA-N 1 1 379.279 3.278 10 0 GGAEMO C[C@@H]1C[N@H+](CCO)CCN1C(=O)Nc1cccc(Cl)c1SCC(F)F ZINC000454841500 567206245 /nfs/dbraw/zinc/20/62/45/567206245.db2.gz WKOYJPDVSPOPHU-LLVKDONJSA-N 1 1 393.887 3.228 10 0 GGAEMO C[C@@H]1C[N@@H+](CCO)CCN1C(=O)Nc1cccc(Cl)c1SCC(F)F ZINC000454841500 567206256 /nfs/dbraw/zinc/20/62/56/567206256.db2.gz WKOYJPDVSPOPHU-LLVKDONJSA-N 1 1 393.887 3.228 10 0 GGAEMO C[C@H](CN(C)C(=O)c1sc2c(c1Br)C[NH2+]C2)c1nccs1 ZINC000659323341 567206545 /nfs/dbraw/zinc/20/65/45/567206545.db2.gz GKSZWNRFLLWTFK-MRVPVSSYSA-N 1 1 386.340 3.446 10 0 GGAEMO O=C(Nc1ccn(CC(F)(F)F)n1)c1sc2c(c1Br)C[NH2+]C2 ZINC000659320833 567206802 /nfs/dbraw/zinc/20/68/02/567206802.db2.gz MXUZWSCBVSXZJL-UHFFFAOYSA-N 1 1 395.204 3.125 10 0 GGAEMO [NH3+]Cc1nc(C(=O)NCC2(Cc3ccc(Br)cc3)CC2)cs1 ZINC000659359470 567207856 /nfs/dbraw/zinc/20/78/56/567207856.db2.gz RUQWKZAQLIPDDF-UHFFFAOYSA-N 1 1 380.311 3.117 10 0 GGAEMO C[NH2+][C@@H](C(=O)NCc1cnc(C(F)(F)F)nc1)c1cccc(Cl)c1Cl ZINC000659338474 567208523 /nfs/dbraw/zinc/20/85/23/567208523.db2.gz XDWTVXTYEIMUCS-GFCCVEGCSA-N 1 1 393.196 3.379 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)CCCOc1cccc(Cl)c1Cl ZINC000590117259 567209757 /nfs/dbraw/zinc/20/97/57/567209757.db2.gz LHIDFMSZEDYWGY-CQSZACIVSA-N 1 1 389.323 3.379 10 0 GGAEMO O=C(Nc1ccc2c(c1)CCOC2)c1sc2c(c1Br)C[NH2+]C2 ZINC000659367341 567210065 /nfs/dbraw/zinc/21/00/65/567210065.db2.gz IEOJQXCTPKVOFG-UHFFFAOYSA-N 1 1 379.279 3.439 10 0 GGAEMO COc1ccccc1[C@@H]1C[C@H]1NC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659372196 567210458 /nfs/dbraw/zinc/21/04/58/567210458.db2.gz BPHQVMVNYWMPDW-CMPLNLGQSA-N 1 1 393.306 3.408 10 0 GGAEMO CO[C@H](CNC(=O)c1sc2c(c1Br)C[NH2+]C2)C1CCCCC1 ZINC000659385762 567211533 /nfs/dbraw/zinc/21/15/33/567211533.db2.gz ZJUZLYIXRRYTDB-GFCCVEGCSA-N 1 1 387.343 3.439 10 0 GGAEMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@@H]2[C@H]3Cc4cc(Br)ccc4[C@@H]23)C1 ZINC000637651678 567211814 /nfs/dbraw/zinc/21/18/14/567211814.db2.gz YJYCRCBDQQUOBL-DUOKCRBOSA-N 1 1 392.341 3.070 10 0 GGAEMO C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2[C@H]3Cc4cc(Br)ccc4[C@@H]23)CC[N@H+]1C ZINC000637650963 567211868 /nfs/dbraw/zinc/21/18/68/567211868.db2.gz RQFFLQMQHWMGRE-OZISYCDHSA-N 1 1 392.341 3.211 10 0 GGAEMO [NH3+]Cc1nc(C(=O)Nc2cc(Cl)ccc2C(=O)[C@@H]2CCCOC2)cs1 ZINC000659386166 567212140 /nfs/dbraw/zinc/21/21/40/567212140.db2.gz MXCKAFIFCZHEPV-SNVBAGLBSA-N 1 1 379.869 3.117 10 0 GGAEMO O=C([C@H]1CCC[N@@H+](Cc2ccc(I)cc2)C1)N1CCCC1 ZINC000524755662 567212196 /nfs/dbraw/zinc/21/21/96/567212196.db2.gz IIQAVOHPKYVFJS-HNNXBMFYSA-N 1 1 398.288 3.126 10 0 GGAEMO O=C([C@H]1CCC[N@H+](Cc2ccc(I)cc2)C1)N1CCCC1 ZINC000524755662 567212202 /nfs/dbraw/zinc/21/22/02/567212202.db2.gz IIQAVOHPKYVFJS-HNNXBMFYSA-N 1 1 398.288 3.126 10 0 GGAEMO Cc1ccc(C)c(OC[C@H](O)C[NH2+][C@@H](C)c2ncc(Br)cn2)c1C ZINC000432987677 567212496 /nfs/dbraw/zinc/21/24/96/567212496.db2.gz FEEGZVUOYIYSCT-GOEBONIOSA-N 1 1 394.313 3.255 10 0 GGAEMO Cc1ccc(C)c(OC[C@@H](O)C[NH2+][C@H](C)c2ncc(Br)cn2)c1C ZINC000432987679 567213013 /nfs/dbraw/zinc/21/30/13/567213013.db2.gz FEEGZVUOYIYSCT-ZBFHGGJFSA-N 1 1 394.313 3.255 10 0 GGAEMO C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2C[C@H]2c2cccc(Br)c2)CC[N@H+]1C ZINC000524787403 567214742 /nfs/dbraw/zinc/21/47/42/567214742.db2.gz QKJRVULWHSNNHN-VDNDLQMASA-N 1 1 380.330 3.429 10 0 GGAEMO CC[N@H+]1C[C@H](C)N(C(=O)N[C@@H]2CCOc3ccc(Br)cc32)C[C@H]1C ZINC000498977169 567216304 /nfs/dbraw/zinc/21/63/04/567216304.db2.gz XYCDKCKEKXQBFH-DVOMOZLQSA-N 1 1 396.329 3.397 10 0 GGAEMO CC[N@H+]1C[C@H](C)N(C(=O)N[C@H]2CCOc3ccc(Br)cc32)C[C@H]1C ZINC000498977171 567217057 /nfs/dbraw/zinc/21/70/57/567217057.db2.gz XYCDKCKEKXQBFH-WWGRRREGSA-N 1 1 396.329 3.397 10 0 GGAEMO C[N@@H+]1CC[C@@H](NC(=O)NCCCc2nccs2)[C@H]1c1ccc(Cl)cc1 ZINC000567092314 567217422 /nfs/dbraw/zinc/21/74/22/567217422.db2.gz BPSBBWJATWRORO-NVXWUHKLSA-N 1 1 378.929 3.474 10 0 GGAEMO C[N@H+]1CC[C@@H](NC(=O)NCCCc2nccs2)[C@H]1c1ccc(Cl)cc1 ZINC000567092314 567217428 /nfs/dbraw/zinc/21/74/28/567217428.db2.gz BPSBBWJATWRORO-NVXWUHKLSA-N 1 1 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GGAEMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000617341165 567299260 /nfs/dbraw/zinc/29/92/60/567299260.db2.gz MGZSNSIBSCTINW-GFCCVEGCSA-N 1 1 380.286 3.122 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000617341773 567299858 /nfs/dbraw/zinc/29/98/58/567299858.db2.gz YMDWKPXZUWHZAZ-KBPBESRZSA-N 1 1 381.314 3.304 10 0 GGAEMO Brc1ccc2nc(CN3CCC[C@@H]([NH+]4CCOCC4)CC3)[nH]c2c1 ZINC000660472884 567299900 /nfs/dbraw/zinc/29/99/00/567299900.db2.gz ATKYNCCAPUYSEL-OAHLLOKOSA-N 1 1 393.329 3.012 10 0 GGAEMO CN1CC[C@@H]([NH2+]Cc2nnc(C(F)(F)F)s2)[C@H]1c1ccc(F)c(F)c1 ZINC000660487423 567301012 /nfs/dbraw/zinc/30/10/12/567301012.db2.gz CTCGXQGWXCPFCJ-DGCLKSJQSA-N 1 1 378.370 3.370 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000617343176 567301326 /nfs/dbraw/zinc/30/13/26/567301326.db2.gz NDFBFGMJQLVUAB-JTQLQIEISA-N 1 1 375.257 3.259 10 0 GGAEMO C[C@H](Cc1ccc(Br)cc1)NC(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000476184709 567303525 /nfs/dbraw/zinc/30/35/25/567303525.db2.gz VGWGOXLPFJBGNM-CXAGYDPISA-N 1 1 380.330 3.258 10 0 GGAEMO COc1cc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc(Br)c1OC ZINC000568090605 567304650 /nfs/dbraw/zinc/30/46/50/567304650.db2.gz QHKIYYPMHLKZTD-YPMHNXCESA-N 1 1 385.302 3.021 10 0 GGAEMO Brc1ccccc1-n1cc(C[N@@H+]2CC[C@H](Cc3ccncc3)C2)nn1 ZINC000685843764 567304746 /nfs/dbraw/zinc/30/47/46/567304746.db2.gz YAMVVPDDKKDDRP-MRXNPFEDSA-N 1 1 398.308 3.489 10 0 GGAEMO Brc1ccccc1-n1cc(C[N@H+]2CC[C@H](Cc3ccncc3)C2)nn1 ZINC000685843764 567304749 /nfs/dbraw/zinc/30/47/49/567304749.db2.gz YAMVVPDDKKDDRP-MRXNPFEDSA-N 1 1 398.308 3.489 10 0 GGAEMO Brc1ccccc1-n1cc(C[N@@H+]2CC[C@@]3(C2)CCCOC3)nn1 ZINC000685846813 567305054 /nfs/dbraw/zinc/30/50/54/567305054.db2.gz GQSSORDDZHKNLP-QGZVFWFLSA-N 1 1 377.286 3.032 10 0 GGAEMO Brc1ccccc1-n1cc(C[N@H+]2CC[C@@]3(C2)CCCOC3)nn1 ZINC000685846813 567305058 /nfs/dbraw/zinc/30/50/58/567305058.db2.gz GQSSORDDZHKNLP-QGZVFWFLSA-N 1 1 377.286 3.032 10 0 GGAEMO CCc1c(C(=O)N[C@@H]2CCC[N@@H+](C)C2)cnn1-c1ccc(Br)cc1 ZINC000617415718 567306087 /nfs/dbraw/zinc/30/60/87/567306087.db2.gz MPWHZZWDSWWASH-CQSZACIVSA-N 1 1 391.313 3.021 10 0 GGAEMO COc1ccc(CNC(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc1Br ZINC000660533032 567306700 /nfs/dbraw/zinc/30/67/00/567306700.db2.gz APQJXKYMHZXMAN-ZDUSSCGKSA-N 1 1 384.318 3.130 10 0 GGAEMO C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)N[C@@H]1CCC[N@@H+](C)C1 ZINC000617414875 567307039 /nfs/dbraw/zinc/30/70/39/567307039.db2.gz SVMWFEWVPULFTR-ZYHUDNBSSA-N 1 1 375.694 3.080 10 0 GGAEMO C[C@@H](NC(=O)[C@H](c1ccc(Cl)cc1)[NH+](C)C)c1ncc(Br)cn1 ZINC000568170236 567309030 /nfs/dbraw/zinc/30/90/30/567309030.db2.gz GOERAHXEZURPON-YGRLFVJLSA-N 1 1 397.704 3.373 10 0 GGAEMO CC(C)[N@@H+](C)CCNC(=O)N[C@@H]1CSCc2ccc(Br)cc21 ZINC000660587490 567309398 /nfs/dbraw/zinc/30/93/98/567309398.db2.gz BKCWYXUKVKBPAQ-OAHLLOKOSA-N 1 1 386.359 3.376 10 0 GGAEMO Cc1ccc2c(c1Br)CN(C(=O)N[C@H]1CC[N@H+]3CCCC[C@@H]13)C2 ZINC000660571481 567309928 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COC(=O)[C@@H]1C[N@@H+](CCC[C@@H]2CCOC2)C[C@H]1c1ccc(Br)cc1 ZINC000592124901 567316657 /nfs/dbraw/zinc/31/66/57/567316657.db2.gz MEFITQGBIGDPGH-FHLIZLRMSA-N 1 1 396.325 3.454 10 0 GGAEMO OCCC1([NH2+]Cc2noc(Cc3ccc(Br)cc3)n2)CCCC1 ZINC000660677994 567319529 /nfs/dbraw/zinc/31/95/29/567319529.db2.gz GWLAIUJXMVBEIM-UHFFFAOYSA-N 1 1 380.286 3.208 10 0 GGAEMO OCCC1([NH2+]Cc2nc(Cc3cccc(Br)c3)no2)CCCC1 ZINC000660678793 567319568 /nfs/dbraw/zinc/31/95/68/567319568.db2.gz SGORNJGWERKTJZ-UHFFFAOYSA-N 1 1 380.286 3.208 10 0 GGAEMO COc1ncc(Br)cc1Cc1noc(C[NH+]2[C@@H](C)CC[C@@H]2C)n1 ZINC000527203342 567319974 /nfs/dbraw/zinc/31/99/74/567319974.db2.gz VTKIEOHUHGTUFC-QWRGUYRKSA-N 1 1 381.274 3.199 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)N1CC[C@H]1c1ccc(Br)cc1 ZINC000660699786 567320252 /nfs/dbraw/zinc/32/02/52/567320252.db2.gz GGVROXFSGJQAIB-IRXDYDNUSA-N 1 1 396.329 3.016 10 0 GGAEMO COc1ncc(Br)cc1Cc1noc(C[NH+]2[C@H](C)CC[C@H]2C)n1 ZINC000527203340 567320597 /nfs/dbraw/zinc/32/05/97/567320597.db2.gz VTKIEOHUHGTUFC-GHMZBOCLSA-N 1 1 381.274 3.199 10 0 GGAEMO CN(C)c1cc(NC(=O)c2c(F)cccc2I)cc[nH+]1 ZINC000500426563 567320980 /nfs/dbraw/zinc/32/09/80/567320980.db2.gz TVLIYZHJJFISRQ-UHFFFAOYSA-N 1 1 385.180 3.144 10 0 GGAEMO CCN(C(=O)CCCC(=O)c1ccc(Br)cc1)[C@@H]1CC[N@@H+](C)C1 ZINC000617551259 567320979 /nfs/dbraw/zinc/32/09/79/567320979.db2.gz OEFMBGNNDFIIFF-MRXNPFEDSA-N 1 1 381.314 3.355 10 0 GGAEMO CCN(C(=O)c1coc(-c2ccc(Br)cc2F)n1)[C@H]1CC[N@@H+](C)C1 ZINC000617552229 567321033 /nfs/dbraw/zinc/32/10/33/567321033.db2.gz JYEOFEIMAAHQRF-LBPRGKRZSA-N 1 1 396.260 3.409 10 0 GGAEMO CCN(C(=O)c1cc(Br)sc1Br)[C@H]1CC[N@@H+](C)C1 ZINC000617554906 567321158 /nfs/dbraw/zinc/32/11/58/567321158.db2.gz MDWRAAPOYIMHPI-QMMMGPOBSA-N 1 1 396.148 3.439 10 0 GGAEMO CS(=O)(=O)c1ccc(C[NH2+][C@@H]2CCOc3c(Br)cccc32)cc1 ZINC000500435339 567321148 /nfs/dbraw/zinc/32/11/48/567321148.db2.gz WCQABHPPAFOZJL-MRXNPFEDSA-N 1 1 396.306 3.466 10 0 GGAEMO CCN(C(=O)c1ccc(Sc2ccccc2Cl)nn1)[C@H]1CC[N@@H+](C)C1 ZINC000617554930 567321187 /nfs/dbraw/zinc/32/11/87/567321187.db2.gz MUJMBJJLSWKUHP-ZDUSSCGKSA-N 1 1 376.913 3.447 10 0 GGAEMO CCN(C(=O)c1cc(C)n(-c2ccc(Br)cc2)n1)[C@@H]1CC[N@@H+](C)C1 ZINC000617553960 567321289 /nfs/dbraw/zinc/32/12/89/567321289.db2.gz UEVVUXGNTGAXPI-MRXNPFEDSA-N 1 1 391.313 3.109 10 0 GGAEMO CCN(C(=O)c1cc(-c2ccc(Br)cc2)n[nH]1)[C@H]1CC[N@@H+](C)C1 ZINC000617559344 567321493 /nfs/dbraw/zinc/32/14/93/567321493.db2.gz YNUOTKHRSAQYKI-AWEZNQCLSA-N 1 1 377.286 3.005 10 0 GGAEMO CCN(C(=O)CCNc1ncc(C(F)(F)F)cc1Cl)[C@@H]1CC[N@@H+](C)C1 ZINC000617554991 567321699 /nfs/dbraw/zinc/32/16/99/567321699.db2.gz OADCJELQLIUYFU-GFCCVEGCSA-N 1 1 378.826 3.108 10 0 GGAEMO CCN(C(=O)Cc1csc(Cc2cccc(Cl)c2)n1)[C@H]1CC[N@@H+](C)C1 ZINC000617551214 567321730 /nfs/dbraw/zinc/32/17/30/567321730.db2.gz NHPDNFFDONOWKQ-KRWDZBQOSA-N 1 1 377.941 3.482 10 0 GGAEMO CCN(C(=O)c1[nH]nc(-c2ccccc2)c1Br)[C@H]1CC[N@@H+](C)C1 ZINC000617556245 567321889 /nfs/dbraw/zinc/32/18/89/567321889.db2.gz MLFYUIGMRPOILN-ZDUSSCGKSA-N 1 1 377.286 3.005 10 0 GGAEMO CCN(C(=O)c1cc(Br)cc(Br)c1)[C@@H]1CC[N@@H+](C)C1 ZINC000617552170 567322230 /nfs/dbraw/zinc/32/22/30/567322230.db2.gz IJOSDHLFBZCZNG-CYBMUJFWSA-N 1 1 390.119 3.378 10 0 GGAEMO CCN(C(=O)[C@@H](CCOC)Cc1cccc(Br)c1)[C@@H]1CC[N@@H+](C)C1 ZINC000617555038 567322273 /nfs/dbraw/zinc/32/22/73/567322273.db2.gz OYWUGYQGSVULSK-FUHWJXTLSA-N 1 1 397.357 3.197 10 0 GGAEMO CCOc1c(Br)cc(C(=O)N(CC)[C@H]2CC[N@@H+](C)C2)cc1OC ZINC000617560422 567323253 /nfs/dbraw/zinc/32/32/53/567323253.db2.gz ORCQBBSNOUNPFU-ZDUSSCGKSA-N 1 1 385.302 3.023 10 0 GGAEMO O=C1C[C@]2(CC[N@H+](Cc3ccc(-c4ccc(Br)cc4)o3)C2)CN1 ZINC000434747949 567323585 /nfs/dbraw/zinc/32/35/85/567323585.db2.gz NOPBIMUGBWJVSS-GOSISDBHSA-N 1 1 375.266 3.421 10 0 GGAEMO CCN(C(=O)c1cc(-c2cccc(Br)c2)no1)[C@H]1CC[N@@H+](C)C1 ZINC000617562124 567324029 /nfs/dbraw/zinc/32/40/29/567324029.db2.gz BEHWOENUBCQQIB-AWEZNQCLSA-N 1 1 378.270 3.270 10 0 GGAEMO Cc1cc(=O)[nH]c(C(C)(C)[NH2+]C[C@H](O)COc2c(Cl)cccc2Cl)n1 ZINC000660744965 567324629 /nfs/dbraw/zinc/32/46/29/567324629.db2.gz ILQCEQNXUNKWTP-NSHDSACASA-N 1 1 386.279 3.062 10 0 GGAEMO CC[C@@H](CO)[NH+]1CCN(C(=O)Nc2cc(Cl)cc(Br)c2)CC1 ZINC000455967272 567326564 /nfs/dbraw/zinc/32/65/64/567326564.db2.gz HOMGYZFTJJEGNX-AWEZNQCLSA-N 1 1 390.709 3.023 10 0 GGAEMO Cc1cc(C(=O)N2CC[N@@H+](C)CC2(C)C)nn1-c1ccc(Br)cc1 ZINC000500485387 567326594 /nfs/dbraw/zinc/32/65/94/567326594.db2.gz MPGFRLHUSKDAHB-UHFFFAOYSA-N 1 1 391.313 3.109 10 0 GGAEMO Cc1cc(C(=O)N2CC[N@H+](C)CC2(C)C)nn1-c1ccc(Br)cc1 ZINC000500485387 567326599 /nfs/dbraw/zinc/32/65/99/567326599.db2.gz MPGFRLHUSKDAHB-UHFFFAOYSA-N 1 1 391.313 3.109 10 0 GGAEMO Brc1ccc(S[C@@H]2CC[N@@H+](C[C@@H]3CCc4ncnn43)C2)cc1 ZINC000639889486 567328064 /nfs/dbraw/zinc/32/80/64/567328064.db2.gz FPCIGEWKKWZQKT-DZGCQCFKSA-N 1 1 379.327 3.395 10 0 GGAEMO O=C(NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1)c1cc(Br)cs1 ZINC000617700034 567328957 /nfs/dbraw/zinc/32/89/57/567328957.db2.gz ZDIFGGGFILSPBO-HNNXBMFYSA-N 1 1 395.322 3.007 10 0 GGAEMO 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3.191 10 0 GGAEMO CCN(C(=O)C[C@H]1Sc2ccc(Cl)cc2NC1=O)[C@@H]1CC[N@@H+](CC)C1 ZINC000617931792 567347316 /nfs/dbraw/zinc/34/73/16/567347316.db2.gz CZVFJIYCOUFBNS-CZUORRHYSA-N 1 1 381.929 3.086 10 0 GGAEMO CCN(C(=O)c1cc2c([nH]1)c(Br)ccc2OC)[C@H]1CC[N@@H+](CC)C1 ZINC000617931029 567347353 /nfs/dbraw/zinc/34/73/53/567347353.db2.gz OFWVATFNQIFCOP-LBPRGKRZSA-N 1 1 394.313 3.495 10 0 GGAEMO CCC[N@H+]1CC[C@H](NC(=O)N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000661127121 567350153 /nfs/dbraw/zinc/35/01/53/567350153.db2.gz HZCARYODKYNEQN-SWLSCSKDSA-N 1 1 382.302 3.056 10 0 GGAEMO CC(C)c1ncc2c(n1)CC[N@@H+](C[C@@H](O)c1ccc(Br)cc1)C2 ZINC000527621806 567350737 /nfs/dbraw/zinc/35/07/37/567350737.db2.gz KHSMLYYBWLNJAR-QGZVFWFLSA-N 1 1 376.298 3.454 10 0 GGAEMO CC(C)c1ncc2c(n1)CC[N@H+](C[C@@H](O)c1ccc(Br)cc1)C2 ZINC000527621806 567350740 /nfs/dbraw/zinc/35/07/40/567350740.db2.gz KHSMLYYBWLNJAR-QGZVFWFLSA-N 1 1 376.298 3.454 10 0 GGAEMO CC(C)N1CC[NH+](CCCN2CCc3ccc(F)c(Br)c3C2)CC1 ZINC000527625396 567352009 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GGAEMO Clc1ccc(OCC[N@H+]2CC[C@H](Cn3ccnn3)C2)c(Br)c1 ZINC000661146092 567352976 /nfs/dbraw/zinc/35/29/76/567352976.db2.gz IIXDGCNOHVPXJQ-LBPRGKRZSA-N 1 1 385.693 3.095 10 0 GGAEMO FC(F)Oc1c(Br)cccc1C[N@@H+]1CC[C@@H](Cn2ccnn2)C1 ZINC000661143052 567353247 /nfs/dbraw/zinc/35/32/47/567353247.db2.gz AXNMRPBUMZKTPQ-LLVKDONJSA-N 1 1 387.228 3.164 10 0 GGAEMO FC(F)Oc1c(Br)cccc1C[N@H+]1CC[C@@H](Cn2ccnn2)C1 ZINC000661143052 567353252 /nfs/dbraw/zinc/35/32/52/567353252.db2.gz AXNMRPBUMZKTPQ-LLVKDONJSA-N 1 1 387.228 3.164 10 0 GGAEMO Brc1ccccc1-c1cnc(C[N@H+]2CC[C@H](Cn3ccnn3)C2)o1 ZINC000661143015 567353388 /nfs/dbraw/zinc/35/33/88/567353388.db2.gz FBEAORFQYPVNKB-ZDUSSCGKSA-N 1 1 388.269 3.218 10 0 GGAEMO FC(F)Oc1ccc(Br)cc1C[N@@H+]1CC[C@@H](Cn2ccnn2)C1 ZINC000661145193 567353454 /nfs/dbraw/zinc/35/34/54/567353454.db2.gz RBCMUUBBQHGKLM-LLVKDONJSA-N 1 1 387.228 3.164 10 0 GGAEMO FC(F)Oc1ccc(Br)cc1C[N@H+]1CC[C@@H](Cn2ccnn2)C1 ZINC000661145193 567353458 /nfs/dbraw/zinc/35/34/58/567353458.db2.gz 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Cc1cc(Br)c(C[NH2+][C@@H](C)CS(C)(=O)=O)cc1Br ZINC000527660564 567356736 /nfs/dbraw/zinc/35/67/36/567356736.db2.gz LHUMNGOQEDDZCR-VIFPVBQESA-N 1 1 399.148 3.043 10 0 GGAEMO Cc1cc(Br)c(C[NH2+][C@H](C)C(=O)N(C)C)cc1Br ZINC000527670383 567357952 /nfs/dbraw/zinc/35/79/52/567357952.db2.gz NSFLQNSDBXBQPA-SECBINFHSA-N 1 1 378.108 3.086 10 0 GGAEMO O=C(NCc1cc(F)ccc1Br)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000527669380 567358412 /nfs/dbraw/zinc/35/84/12/567358412.db2.gz FZETZBXKSJDDOR-OAHLLOKOSA-N 1 1 384.293 3.404 10 0 GGAEMO OC[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1ccsc1Br ZINC000527663897 567358621 /nfs/dbraw/zinc/35/86/21/567358621.db2.gz GJJCHRSACDWWNO-SJORKVTESA-N 1 1 395.366 3.483 10 0 GGAEMO COC(=O)c1ccc(Br)cc1C[N@@H+]1CC[C@@H](Cc2cnn(C)c2)C1 ZINC000548918252 567360454 /nfs/dbraw/zinc/36/04/54/567360454.db2.gz IVNGPDGTEYBKFL-ZDUSSCGKSA-N 1 1 392.297 3.034 10 0 GGAEMO COC(=O)c1ccc(Br)cc1C[N@H+]1CC[C@@H](Cc2cnn(C)c2)C1 ZINC000548918252 567360458 /nfs/dbraw/zinc/36/04/58/567360458.db2.gz 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ZINC000527702943 567365082 /nfs/dbraw/zinc/36/50/82/567365082.db2.gz FOUNMYFTIOCIHH-OQPBUACISA-N 1 1 390.119 3.134 10 0 GGAEMO C[N@H+]1CCCC[C@@H]1CN1CCN(C(=O)c2cc(F)c(Cl)cc2Cl)CC1 ZINC000501110586 567365935 /nfs/dbraw/zinc/36/59/35/567365935.db2.gz KIXYZTFEYSMFBL-CYBMUJFWSA-N 1 1 388.314 3.375 10 0 GGAEMO Brc1ccc(-c2n[nH]cc2C[NH2+][C@H]2CCc3[nH]cnc3C2)s1 ZINC000527708545 567366820 /nfs/dbraw/zinc/36/68/20/567366820.db2.gz BUUIDDKXBGWZMU-JTQLQIEISA-N 1 1 378.299 3.271 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CN1CCN(C(=O)Cc2c(Cl)cccc2Cl)CC1 ZINC000501139201 567367475 /nfs/dbraw/zinc/36/74/75/567367475.db2.gz ABMDCOKTJWXAFX-HNNXBMFYSA-N 1 1 384.351 3.164 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CN1CCN(C(=O)Cc2ccc(Cl)cc2Cl)CC1 ZINC000501124983 567367724 /nfs/dbraw/zinc/36/77/24/567367724.db2.gz HLQRSJFGEVZLMJ-KRWDZBQOSA-N 1 1 384.351 3.164 10 0 GGAEMO COCC(COC)[NH2+]Cc1cc(Br)c(C)cc1Br ZINC000527718100 567368498 /nfs/dbraw/zinc/36/84/98/567368498.db2.gz URJNZYIGHSZHKF-UHFFFAOYSA-N 1 1 381.108 3.271 10 0 GGAEMO CC[C@H]([NH2+]Cc1cc(Br)c(C)cc1Br)C(=O)NC ZINC000527715215 567368963 /nfs/dbraw/zinc/36/89/63/567368963.db2.gz FNQFAQPQZBIJBG-LBPRGKRZSA-N 1 1 378.108 3.134 10 0 GGAEMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)NCCc1ccccc1Br ZINC000549030927 567369301 /nfs/dbraw/zinc/36/93/01/567369301.db2.gz CMJICGPRDVBJNY-CYBMUJFWSA-N 1 1 379.302 3.132 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2c(Cl)cc(F)cc2Cl)[C@H](C)C1 ZINC000435443448 567369340 /nfs/dbraw/zinc/36/93/40/567369340.db2.gz NZDJSEWEVXQRRR-YGRLFVJLSA-N 1 1 383.316 3.483 10 0 GGAEMO CCC[N@@H+](C)CC(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 ZINC000592862605 567370344 /nfs/dbraw/zinc/37/03/44/567370344.db2.gz PTULCXBULWLFEW-UHFFFAOYSA-N 1 1 382.291 3.484 10 0 GGAEMO O=C(NCc1ccc(Br)c(F)c1F)N[C@@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000527723464 567370490 /nfs/dbraw/zinc/37/04/90/567370490.db2.gz AEWHHWLPRQHBPO-OLZOCXBDSA-N 1 1 388.256 3.153 10 0 GGAEMO O=C(NCc1ccc(Br)c(F)c1F)N[C@H]1CC[N@H+]2CCCC[C@@H]12 ZINC000527723466 567370529 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FC(F)(F)[C@@H](C[NH2+]Cc1cc(Br)cc2c1OCC2)n1cccn1 ZINC000527741442 567371832 /nfs/dbraw/zinc/37/18/32/567371832.db2.gz BRVDZWGROSSTKT-CYBMUJFWSA-N 1 1 390.203 3.474 10 0 GGAEMO FC(F)(F)[C@H](C[NH2+]Cc1cc(Br)cc2c1OCC2)n1cccn1 ZINC000527741443 567371993 /nfs/dbraw/zinc/37/19/93/567371993.db2.gz BRVDZWGROSSTKT-ZDUSSCGKSA-N 1 1 390.203 3.474 10 0 GGAEMO FC(F)(F)[C@H](C[NH2+]Cc1cc2c(cc1Br)OCO2)n1cccn1 ZINC000527741841 567372368 /nfs/dbraw/zinc/37/23/68/567372368.db2.gz IHVPRAWKAYCYOR-ZDUSSCGKSA-N 1 1 392.175 3.268 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)N[C@@H](C)Cc1ccc(Cl)cc1Cl ZINC000477130958 567372379 /nfs/dbraw/zinc/37/23/79/567372379.db2.gz BNSIRBRUAJQUTO-BBRMVZONSA-N 1 1 388.339 3.334 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)NCC(=O)Nc1cc(Cl)ccc1Cl ZINC000661398930 567372942 /nfs/dbraw/zinc/37/29/42/567372942.db2.gz WWDQBNJLHLYEQT-GFCCVEGCSA-N 1 1 387.311 3.104 10 0 GGAEMO O=C(NCc1cc(F)c(Br)cc1F)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000527796225 567374568 /nfs/dbraw/zinc/37/45/68/567374568.db2.gz LXWKDUCBNLAAQU-SNVBAGLBSA-N 1 1 388.256 3.011 10 0 GGAEMO CCC[N@H+]1CC[C@@H](CNC(=O)NCc2cc(F)c(Br)cc2F)C1 ZINC000527800362 567374599 /nfs/dbraw/zinc/37/45/99/567374599.db2.gz NGAYSTZYPVDKCS-NSHDSACASA-N 1 1 390.272 3.258 10 0 GGAEMO C[C@@H]1C[C@H](NC(=O)NCc2ccc(Br)c(F)c2F)CC[N@H+]1C ZINC000527807553 567374617 /nfs/dbraw/zinc/37/46/17/567374617.db2.gz LCDRZXWKNLNAKF-MWLCHTKSSA-N 1 1 376.245 3.009 10 0 GGAEMO Fc1cc(C[NH2+]Cc2cnc(N3CCCC3)nc2)c(F)cc1Br ZINC000527791430 567374754 /nfs/dbraw/zinc/37/47/54/567374754.db2.gz LJIJXHQYHYTEEJ-UHFFFAOYSA-N 1 1 383.240 3.407 10 0 GGAEMO CC(C)[N@H+]1CC[C@@H](CNC(=O)NCc2ccc(Br)c(F)c2F)C1 ZINC000527797739 567375013 /nfs/dbraw/zinc/37/50/13/567375013.db2.gz DHIFCGVMYSSLMK-NSHDSACASA-N 1 1 390.272 3.257 10 0 GGAEMO Fc1c(Br)ccc(C[NH2+]Cc2cnc(N3CCCC3)nc2)c1F ZINC000527789898 567375142 /nfs/dbraw/zinc/37/51/42/567375142.db2.gz HCRIHSMPIXFINS-UHFFFAOYSA-N 1 1 383.240 3.407 10 0 GGAEMO C[C@@]12COC[C@]1(C)C[N@@H+](Cc1nc(-c3cccc(Br)c3)no1)C2 ZINC000661499104 567377205 /nfs/dbraw/zinc/37/72/05/567377205.db2.gz KKLRNBHWHWWITP-CALCHBBNSA-N 1 1 378.270 3.358 10 0 GGAEMO C[C@@]12COC[C@]1(C)C[N@H+](Cc1nc(-c3cccc(Br)c3)no1)C2 ZINC000661499104 567377209 /nfs/dbraw/zinc/37/72/09/567377209.db2.gz KKLRNBHWHWWITP-CALCHBBNSA-N 1 1 378.270 3.358 10 0 GGAEMO C[C@@]12COC[C@]1(C)C[N@H+](CCC(=O)Nc1ccc(Br)cc1F)C2 ZINC000661503220 567377336 /nfs/dbraw/zinc/37/73/36/567377336.db2.gz WAHJFGQEUIOPBT-CALCHBBNSA-N 1 1 385.277 3.275 10 0 GGAEMO NC(=O)C[C@H]1CCCC[N@@H+]1Cc1cc(Cl)ccc1I ZINC000593012437 567378264 /nfs/dbraw/zinc/37/82/64/567378264.db2.gz XEDKAVAOSXYIGT-GFCCVEGCSA-N 1 1 392.668 3.175 10 0 GGAEMO NC(=O)C[C@H]1CCCC[N@H+]1Cc1cc(Cl)ccc1I ZINC000593012437 567378269 /nfs/dbraw/zinc/37/82/69/567378269.db2.gz XEDKAVAOSXYIGT-GFCCVEGCSA-N 1 1 392.668 3.175 10 0 GGAEMO CC(C)(C)NC(=O)NC(=O)C[NH2+]C1(c2ccccc2Br)CCC1 ZINC000593038342 567381373 /nfs/dbraw/zinc/38/13/73/567381373.db2.gz CUEDJOXAAUULST-UHFFFAOYSA-N 1 1 382.302 3.042 10 0 GGAEMO O=C(NCc1c[nH+]c2n1CCCC2)NCc1cc(F)c(Br)cc1F ZINC000527912610 567383191 /nfs/dbraw/zinc/38/31/91/567383191.db2.gz FOUKYXNRBDAMEP-UHFFFAOYSA-N 1 1 399.239 3.260 10 0 GGAEMO O=C(NCc1c[nH+]c2n1CCCC2)NCc1ccc(Br)c(F)c1F ZINC000527911620 567383485 /nfs/dbraw/zinc/38/34/85/567383485.db2.gz BXXSTMODPVHUQY-UHFFFAOYSA-N 1 1 399.239 3.260 10 0 GGAEMO CCC[C@H]1CN(C(=O)Nc2ncc(C(F)(F)F)s2)CC[N@H+]1CCOC ZINC000549287263 567384059 /nfs/dbraw/zinc/38/40/59/567384059.db2.gz HUQLEXYLDAIWEW-NSHDSACASA-N 1 1 380.436 3.127 10 0 GGAEMO C[C@H](C(=O)N(C)Cc1ccc(Br)cc1)[N@H+]1CCC[C@@](O)(C2CC2)C1 ZINC000661630873 567384252 /nfs/dbraw/zinc/38/42/52/567384252.db2.gz CYTFBSPBPZJZSJ-KUHUBIRLSA-N 1 1 395.341 3.033 10 0 GGAEMO Cc1ccc(I)cc1C(=O)NCC[N@@H+]1CCCC[C@H]1C ZINC000477304532 567386505 /nfs/dbraw/zinc/38/65/05/567386505.db2.gz CFXVFSZIYUJFSD-CYBMUJFWSA-N 1 1 386.277 3.204 10 0 GGAEMO CS(=O)(=O)[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc(F)c(Br)cc1F ZINC000527981329 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C[N@@H+]1CCC[C@@H](NS(=O)(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 ZINC000618463014 567390917 /nfs/dbraw/zinc/39/09/17/567390917.db2.gz XRVYBTVMWIRTSU-LLVKDONJSA-N 1 1 390.349 3.097 10 0 GGAEMO C[N@H+]1CCC[C@@H](NS(=O)(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1 ZINC000618463014 567390925 /nfs/dbraw/zinc/39/09/25/567390925.db2.gz XRVYBTVMWIRTSU-LLVKDONJSA-N 1 1 390.349 3.097 10 0 GGAEMO O=C(C[NH2+][C@@H]1CCOc2c(Br)cccc21)NCc1ccc(F)cc1 ZINC000501496034 567392711 /nfs/dbraw/zinc/39/27/11/567392711.db2.gz RHYZUAVBQRGALI-MRXNPFEDSA-N 1 1 393.256 3.318 10 0 GGAEMO CNS(=O)(=O)CCC[N@@H+]1CCc2sccc2[C@H]1c1ccc(Cl)cc1 ZINC000661790810 567392930 /nfs/dbraw/zinc/39/29/30/567392930.db2.gz HJPRYWKEIKXLPP-QGZVFWFLSA-N 1 1 384.954 3.288 10 0 GGAEMO CNS(=O)(=O)CCC[N@H+]1CCc2sccc2[C@H]1c1ccc(Cl)cc1 ZINC000661790810 567392938 /nfs/dbraw/zinc/39/29/38/567392938.db2.gz HJPRYWKEIKXLPP-QGZVFWFLSA-N 1 1 384.954 3.288 10 0 GGAEMO O=C(C[NH2+][C@@H]1CCOc2c(Br)cccc21)NCc1ccccc1F ZINC000501515567 567394482 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10 0 GGAEMO COc1cc(C)nc(C[NH2+]CC(=O)Nc2ccc(Br)c(C)c2)c1 ZINC000478199407 567441197 /nfs/dbraw/zinc/44/11/97/567441197.db2.gz QWRHHFAAIKAUPS-UHFFFAOYSA-N 1 1 378.270 3.198 10 0 GGAEMO Cc1n[nH]c(C)c1[C@H]1CCCN1C(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000662509847 567442932 /nfs/dbraw/zinc/44/29/32/567442932.db2.gz SDTBAHIBZAKBPC-LLVKDONJSA-N 1 1 395.326 3.431 10 0 GGAEMO Cn1cc([C@H](NC(=O)c2sc3c(c2Br)C[NH2+]C3)C(C)(C)C)cn1 ZINC000662500195 567442994 /nfs/dbraw/zinc/44/29/94/567442994.db2.gz JCXVZWHRWFDARK-AWEZNQCLSA-N 1 1 397.342 3.365 10 0 GGAEMO OC[C@H]1CCC2(CCOCC2)C[N@@H+]1Cc1nc2cc(Br)ccc2[nH]1 ZINC000528635827 567443093 /nfs/dbraw/zinc/44/30/93/567443093.db2.gz BTHKPJGKFZGUTN-CQSZACIVSA-N 1 1 394.313 3.079 10 0 GGAEMO OC[C@H]1CCC2(CCOCC2)C[N@H+]1Cc1nc2cc(Br)ccc2[nH]1 ZINC000528635827 567443096 /nfs/dbraw/zinc/44/30/96/567443096.db2.gz BTHKPJGKFZGUTN-CQSZACIVSA-N 1 1 394.313 3.079 10 0 GGAEMO OC[C@H]1CCC2(CCOCC2)C[N@@H+]1Cc1nc2ccc(Br)cc2[nH]1 ZINC000528635827 567443104 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CC[N@H+]1CC[C@H]2OCCN(C(=O)[C@@H](C)Oc3cccc(Cl)c3Cl)[C@H]2C1 ZINC000502575198 567444323 /nfs/dbraw/zinc/44/43/23/567444323.db2.gz GBWBIZWCGFHEND-VHDGCEQUSA-N 1 1 387.307 3.082 10 0 GGAEMO OC[C@H]1CCC2(CCOCC2)C[N@H+]1Cc1nc2ccc(Br)cc2o1 ZINC000528645839 567444787 /nfs/dbraw/zinc/44/47/87/567444787.db2.gz QGJGKJCQHUZAJR-CQSZACIVSA-N 1 1 395.297 3.344 10 0 GGAEMO OC[C@H]1CCC2(CCOCC2)C[N@@H+]1Cc1cn2cc(Cl)cc(Cl)c2n1 ZINC000528639845 567444984 /nfs/dbraw/zinc/44/49/84/567444984.db2.gz LTNPMFUXSAGNCK-OAHLLOKOSA-N 1 1 384.307 3.395 10 0 GGAEMO OC[C@H]1CCC2(CCOCC2)C[N@H+]1Cc1cn2cc(Cl)cc(Cl)c2n1 ZINC000528639845 567444990 /nfs/dbraw/zinc/44/49/90/567444990.db2.gz LTNPMFUXSAGNCK-OAHLLOKOSA-N 1 1 384.307 3.395 10 0 GGAEMO O=C(NC[C@H](CCO)c1ccccc1)c1sc2c(c1Br)C[NH2+]C2 ZINC000662531391 567446181 /nfs/dbraw/zinc/44/61/81/567446181.db2.gz UTQDKRSOJOYECM-LBPRGKRZSA-N 1 1 395.322 3.010 10 0 GGAEMO COCC[N@H+]1CC[C@@H](NC(=O)c2cc(Br)cc3ccccc32)C1 ZINC000593915465 567446357 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CC[N@H+]1CC[C@H]2OCCN(C(=O)C(C)(C)c3cccc(Br)c3)[C@H]2C1 ZINC000502715083 567448634 /nfs/dbraw/zinc/44/86/34/567448634.db2.gz ZSDYXSCXAIRHBE-DLBZAZTESA-N 1 1 395.341 3.048 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)CCOc3ccc(Cl)cc3Cl)[C@H]2C1 ZINC000502726660 567448798 /nfs/dbraw/zinc/44/87/98/567448798.db2.gz ODYXXUNBLSFVHC-DOTOQJQBSA-N 1 1 387.307 3.084 10 0 GGAEMO Cc1c[nH+]cn1CC(=O)N1CCC[C@H]1c1ccc(I)cc1 ZINC000528702311 567448873 /nfs/dbraw/zinc/44/88/73/567448873.db2.gz GPWAVRRWQKUFJG-HNNXBMFYSA-N 1 1 395.244 3.160 10 0 GGAEMO Cc1cc(Br)cc(C(=O)NC2CCC([NH+]3CCNCC3)CC2)c1C ZINC000662571789 567450027 /nfs/dbraw/zinc/45/00/27/567450027.db2.gz RTWKPBOILBADJI-UHFFFAOYSA-N 1 1 394.357 3.012 10 0 GGAEMO [NH3+][C@H](C(=O)N[C@@H](C[C@@H]1CCCO1)C(F)(F)F)c1ccccc1Br ZINC000662585924 567451266 /nfs/dbraw/zinc/45/12/66/567451266.db2.gz MDAAZBVSWYPFEB-XDTLVQLUSA-N 1 1 395.219 3.065 10 0 GGAEMO C[C@]12CC[N@@H+]([C@H]3CC(=O)N(c4ccc(Br)cc4)C3=O)C[C@H]1C2(F)F ZINC000570024479 567452382 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C[C@H](CCNC(=O)c1cc(Br)cc2nc[nH]c21)[NH+]1CCCCC1 ZINC000502841273 567455750 /nfs/dbraw/zinc/45/57/50/567455750.db2.gz IRIFUBKVXZJNLJ-GFCCVEGCSA-N 1 1 379.302 3.320 10 0 GGAEMO C[C@@H](NC(=O)C[N@@H+]1CC[C@H]2CC[C@@H](C1)[S@]2=O)c1ccc(Cl)c(Cl)c1 ZINC000528785539 567456015 /nfs/dbraw/zinc/45/60/15/567456015.db2.gz YKLUHRCLIXGECU-XTPXEVAXSA-N 1 1 389.348 3.156 10 0 GGAEMO C[C@@H](NC(=O)C[N@H+]1CC[C@H]2CC[C@@H](C1)[S@]2=O)c1ccc(Cl)c(Cl)c1 ZINC000528785539 567456019 /nfs/dbraw/zinc/45/60/19/567456019.db2.gz YKLUHRCLIXGECU-XTPXEVAXSA-N 1 1 389.348 3.156 10 0 GGAEMO O=c1ccc([C@H]2CCC[N@@H+]2C[C@H](O)COc2ccc(Cl)cc2Cl)n[nH]1 ZINC000528787627 567456105 /nfs/dbraw/zinc/45/61/05/567456105.db2.gz BULGSLHFZZEIFZ-SWLSCSKDSA-N 1 1 384.263 3.066 10 0 GGAEMO O=c1ccc([C@H]2CCC[N@@H+]2C[C@@H](O)COc2ccc(Cl)cc2Cl)n[nH]1 ZINC000528787626 567456217 /nfs/dbraw/zinc/45/62/17/567456217.db2.gz BULGSLHFZZEIFZ-IUODEOHRSA-N 1 1 384.263 3.066 10 0 GGAEMO O=c1ccc([C@@H]2CCC[N@@H+]2C[C@H](O)COc2cc(Cl)ccc2Cl)n[nH]1 ZINC000528792749 567456269 /nfs/dbraw/zinc/45/62/69/567456269.db2.gz VJGOLDJPXPLNIB-WFASDCNBSA-N 1 1 384.263 3.066 10 0 GGAEMO C[C@@H](CCNC(=O)c1cc(Br)cc2nc[nH]c21)[NH+]1CCCCC1 ZINC000502841276 567456367 /nfs/dbraw/zinc/45/63/67/567456367.db2.gz IRIFUBKVXZJNLJ-LBPRGKRZSA-N 1 1 379.302 3.320 10 0 GGAEMO C[C@H](NC(=O)C[N@@H+]1CC[C@H]2CC[C@@H](C1)[S@]2=O)c1ccc(Cl)c(Cl)c1 ZINC000528785541 567456434 /nfs/dbraw/zinc/45/64/34/567456434.db2.gz YKLUHRCLIXGECU-AOTXOMBVSA-N 1 1 389.348 3.156 10 0 GGAEMO C[C@H](NC(=O)C[N@H+]1CC[C@H]2CC[C@@H](C1)[S@]2=O)c1ccc(Cl)c(Cl)c1 ZINC000528785541 567456437 /nfs/dbraw/zinc/45/64/37/567456437.db2.gz YKLUHRCLIXGECU-AOTXOMBVSA-N 1 1 389.348 3.156 10 0 GGAEMO O=c1ccc([C@H]2CCC[N@@H+]2C[C@H](O)COc2cc(Cl)ccc2Cl)n[nH]1 ZINC000528792745 567456623 /nfs/dbraw/zinc/45/66/23/567456623.db2.gz VJGOLDJPXPLNIB-SWLSCSKDSA-N 1 1 384.263 3.066 10 0 GGAEMO O=c1ccc([C@@H]2CCC[N@@H+]2C[C@@H](O)COc2ccc(Cl)cc2Cl)n[nH]1 ZINC000528787625 567456981 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GGAEMO CC(=O)NCC[N@H+](Cc1ccc(Cl)cc1Cl)C[C@@H](O)CC(F)(F)F ZINC000502864911 567459138 /nfs/dbraw/zinc/45/91/38/567459138.db2.gz WVFOKDFVPGEDRH-ZDUSSCGKSA-N 1 1 387.229 3.245 10 0 GGAEMO C[NH2+][C@@H](C(=O)N1CCC[C@@H](C(=O)NC(C)C)C1)c1cccc(Cl)c1Cl ZINC000662737057 567459428 /nfs/dbraw/zinc/45/94/28/567459428.db2.gz KGZUGVROWDLQDW-MLGOLLRUSA-N 1 1 386.323 3.017 10 0 GGAEMO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H](C)[C@H]1NC(=O)[C@@H]1C[C@@]1(C)Br ZINC000528834439 567461261 /nfs/dbraw/zinc/46/12/61/567461261.db2.gz NSGCFJYQROYUIM-CARYNNKMSA-N 1 1 379.342 3.433 10 0 GGAEMO CC1(C)CN(C(=O)c2sc3c(c2Br)C[NH2+]C3)[C@@H]1[C@H]1CCCO1 ZINC000662757790 567461343 /nfs/dbraw/zinc/46/13/43/567461343.db2.gz IXIISWQSJBIPPA-QMTHXVAHSA-N 1 1 385.327 3.143 10 0 GGAEMO Brc1cccc2c(C[N@@H+]3CC[C@@H](Nc4ncccn4)C3)ccnc12 ZINC000570162344 567462659 /nfs/dbraw/zinc/46/26/59/567462659.db2.gz LGVSSDDOMNZEER-CQSZACIVSA-N 1 1 384.281 3.474 10 0 GGAEMO Brc1cccc2c(C[N@H+]3CC[C@@H](Nc4ncccn4)C3)ccnc12 ZINC000570162344 567462662 /nfs/dbraw/zinc/46/26/62/567462662.db2.gz LGVSSDDOMNZEER-CQSZACIVSA-N 1 1 384.281 3.474 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCC[C@@H]1[C@@H]1CCCOC1 ZINC000662819373 567462971 /nfs/dbraw/zinc/46/29/71/567462971.db2.gz DKUPWYQRUHRRDG-ZYHUDNBSSA-N 1 1 385.327 3.145 10 0 GGAEMO CCOc1cccc(CCNC(=O)c2sc3c(c2Br)C[NH2+]C3)c1 ZINC000662822823 567464110 /nfs/dbraw/zinc/46/41/10/567464110.db2.gz QMUPSFUUTLQEPM-UHFFFAOYSA-N 1 1 395.322 3.485 10 0 GGAEMO Cn1nccc1[C@@H]1CCCCN1C(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000662828426 567464355 /nfs/dbraw/zinc/46/43/55/567464355.db2.gz JKHHIIFMWUMBDE-LBPRGKRZSA-N 1 1 395.326 3.215 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)N[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000503026637 567465429 /nfs/dbraw/zinc/46/54/29/567465429.db2.gz NYLNMGJGCOIFJQ-BLLLJJGKSA-N 1 1 386.323 3.391 10 0 GGAEMO CC(C)[N@H+]1CCC[C@@H](NC(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000503067048 567468151 /nfs/dbraw/zinc/46/81/51/567468151.db2.gz ZRLQBAXIKKBSSS-LLVKDONJSA-N 1 1 375.257 3.259 10 0 GGAEMO COc1cc(NC(=O)c2c[nH]nc2[C@H]2CC[NH2+]C2)c(Cl)cc1Br ZINC000662920014 567468993 /nfs/dbraw/zinc/46/89/93/567468993.db2.gz QQQKNOUXEDCGLL-QMMMGPOBSA-N 1 1 399.676 3.163 10 0 GGAEMO COC[C@@H]([NH2+]CC(=O)N1CCC[C@H](C(F)(F)F)C1)c1cccc(Cl)c1 ZINC000570244508 567469309 /nfs/dbraw/zinc/46/93/09/567469309.db2.gz OEDHUGOVJIBPBH-DZGCQCFKSA-N 1 1 378.822 3.418 10 0 GGAEMO C[C@@H](CNC(=O)c1cc(Br)cc2nc[nH]c21)C[NH+]1CCCCC1 ZINC000503129207 567469980 /nfs/dbraw/zinc/46/99/80/567469980.db2.gz FFPPKSCLUGKHSS-LBPRGKRZSA-N 1 1 379.302 3.177 10 0 GGAEMO C[NH2+][C@@H](C(=O)N1CCO[C@@H](CC(F)(F)F)C1)c1cccc(Cl)c1Cl ZINC000662949044 567470166 /nfs/dbraw/zinc/47/01/66/567470166.db2.gz CVTZYMMNIZOWDI-TVQRCGJNSA-N 1 1 385.213 3.434 10 0 GGAEMO Cc1cc(CNC(=O)N2CC[NH2+]C[C@H]2c2cccnc2)ccc1Br ZINC000570265333 567471369 /nfs/dbraw/zinc/47/13/69/567471369.db2.gz VSKHLKFNTCXBGM-KRWDZBQOSA-N 1 1 389.297 3.009 10 0 GGAEMO C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)c1cc(Br)cc2[nH]cnc21 ZINC000503183375 567471902 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GGAEMO C[C@H]1CCCN(S(=O)(=O)NC[C@H](c2cccc(Cl)c2)[NH+]2CCCC2)C1 ZINC000642335323 567476393 /nfs/dbraw/zinc/47/63/93/567476393.db2.gz VRBVWZKBYDOMRT-MAUKXSAKSA-N 1 1 385.961 3.043 10 0 GGAEMO C[C@H]1CCCN(S(=O)(=O)NC[C@@H](c2cccc(Cl)c2)[NH+]2CCCC2)C1 ZINC000642335325 567476449 /nfs/dbraw/zinc/47/64/49/567476449.db2.gz VRBVWZKBYDOMRT-YJBOKZPZSA-N 1 1 385.961 3.043 10 0 GGAEMO CC(=O)NCC[N@@H+](CC[C@@H]1CCCCO1)Cc1ccc(Br)s1 ZINC000503248367 567476643 /nfs/dbraw/zinc/47/66/43/567476643.db2.gz YYVNPHGMHGKJCY-AWEZNQCLSA-N 1 1 389.359 3.408 10 0 GGAEMO Cc1[nH+]ccn1CC(=O)N1CCC[C@H]1c1ccccc1I ZINC000457583148 567476726 /nfs/dbraw/zinc/47/67/26/567476726.db2.gz WRYWEYHVWYMITJ-HNNXBMFYSA-N 1 1 395.244 3.160 10 0 GGAEMO CC(=O)NCC[N@@H+](CC[C@H]1CCCCO1)Cc1ccc(Br)s1 ZINC000503248368 567477333 /nfs/dbraw/zinc/47/73/33/567477333.db2.gz YYVNPHGMHGKJCY-CQSZACIVSA-N 1 1 389.359 3.408 10 0 GGAEMO C[C@H](NC(=O)C[N@H+]1CC[C@H](C)C1)c1nc(-c2ccc(Br)cc2)no1 ZINC000570343524 567477677 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C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1cc(Br)cc2nc[nH]c21 ZINC000503293126 567480574 /nfs/dbraw/zinc/48/05/74/567480574.db2.gz SGWDUFSTYDBPHD-TXEJJXNPSA-N 1 1 379.302 3.318 10 0 GGAEMO Cc1ccsc1-c1nc(=NC(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)s[n-]1 ZINC000529063117 567482171 /nfs/dbraw/zinc/48/21/71/567482171.db2.gz IKLDEBYZCUZVEG-ZDUSSCGKSA-N 1 1 377.539 3.135 10 0 GGAEMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)S(=O)(=O)c1cccc(Br)c1Cl ZINC000551168324 567482786 /nfs/dbraw/zinc/48/27/86/567482786.db2.gz XUUHFSXGGRHQER-CMPLNLGQSA-N 1 1 395.750 3.063 10 0 GGAEMO CCC[N@H+]1CC[C@@H](NC(=O)c2c(F)c(F)c(Br)c(F)c2F)C1 ZINC000619903635 567486403 /nfs/dbraw/zinc/48/64/03/567486403.db2.gz BGCZFLJCRNILFP-SSDOTTSWSA-N 1 1 383.183 3.220 10 0 GGAEMO Cc1sc(C(=O)N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)cc1Br ZINC000619966427 567487624 /nfs/dbraw/zinc/48/76/24/567487624.db2.gz KDYFRVUIVICONO-HUUCEWRRSA-N 1 1 399.354 3.192 10 0 GGAEMO COc1ccccc1NC(=O)C[C@@H](C)[NH2+][C@H](C)c1ncc(Br)cn1 ZINC000551209535 567488451 /nfs/dbraw/zinc/48/84/51/567488451.db2.gz GKJUCAFWIMYAAD-VXGBXAGGSA-N 1 1 393.285 3.316 10 0 GGAEMO COc1ccccc1NC(=O)C[C@H](C)[NH2+][C@H](C)c1ncc(Br)cn1 ZINC000551209533 567488497 /nfs/dbraw/zinc/48/84/97/567488497.db2.gz GKJUCAFWIMYAAD-NWDGAFQWSA-N 1 1 393.285 3.316 10 0 GGAEMO COc1ccccc1NC(=O)C[C@H](C)[NH2+][C@@H](C)c1ncc(Br)cn1 ZINC000551209534 567488646 /nfs/dbraw/zinc/48/86/46/567488646.db2.gz GKJUCAFWIMYAAD-RYUDHWBXSA-N 1 1 393.285 3.316 10 0 GGAEMO Cc1ccc(C(=O)N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c(Br)c1 ZINC000619971158 567488637 /nfs/dbraw/zinc/48/86/37/567488637.db2.gz JZQDPLHJIIPVGH-IAGOWNOFSA-N 1 1 393.325 3.131 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)Cn2ccc(C(F)F)n2)cc1Br ZINC000529127669 567489290 /nfs/dbraw/zinc/48/92/90/567489290.db2.gz HAHYQROPIRWMIG-UHFFFAOYSA-N 1 1 387.228 3.284 10 0 GGAEMO C[C@H](CC(=O)Nc1cccc(F)c1)[NH2+][C@H](C)c1ncc(Br)cn1 ZINC000551223761 567489729 /nfs/dbraw/zinc/48/97/29/567489729.db2.gz WUUIFYHOEPFEFT-GHMZBOCLSA-N 1 1 381.249 3.446 10 0 GGAEMO COC(=O)[C@@H]1CSCC[N@@H+](Cc2cn(-c3ccccc3Cl)nc2C)C1 ZINC000594606312 567489794 /nfs/dbraw/zinc/48/97/94/567489794.db2.gz KGTYJGDNNCNSKO-HNNXBMFYSA-N 1 1 379.913 3.172 10 0 GGAEMO COC(=O)c1cc(C[NH2+]Cc2cc3c(c(Br)c2)OCO3)c(C)o1 ZINC000594605015 567489908 /nfs/dbraw/zinc/48/99/08/567489908.db2.gz DHIQSIZLSXELAI-UHFFFAOYSA-N 1 1 382.210 3.156 10 0 GGAEMO COC(=O)[C@H]1CSCC[N@@H+](Cc2cn(-c3ccccc3Cl)nc2C)C1 ZINC000594606314 567490129 /nfs/dbraw/zinc/49/01/29/567490129.db2.gz KGTYJGDNNCNSKO-OAHLLOKOSA-N 1 1 379.913 3.172 10 0 GGAEMO COC(=O)c1cc(C[NH2+]Cc2cc(Br)c3c(c2)OCCO3)c(C)o1 ZINC000594611649 567490401 /nfs/dbraw/zinc/49/04/01/567490401.db2.gz HLTJSJWZRUZMCE-UHFFFAOYSA-N 1 1 396.237 3.198 10 0 GGAEMO Cc1cc(C[NH2+]Cc2ccc(I)cc2Cl)n(C)n1 ZINC000551237967 567490948 /nfs/dbraw/zinc/49/09/48/567490948.db2.gz OOHOFADCGQGCOT-UHFFFAOYSA-N 1 1 375.641 3.276 10 0 GGAEMO C[N@H+]1CCCC12CCN(C(=O)Cc1c(F)ccc(Br)c1F)CC2 ZINC000503525127 567491765 /nfs/dbraw/zinc/49/17/65/567491765.db2.gz ZSULJZYSGRSGCK-UHFFFAOYSA-N 1 1 387.268 3.357 10 0 GGAEMO COC(=O)c1cc(C[NH2+]Cc2cc(OC)c(OC)cc2Br)c(C)o1 ZINC000594615552 567492067 /nfs/dbraw/zinc/49/20/67/567492067.db2.gz PCBMCLBWMVMJJH-UHFFFAOYSA-N 1 1 398.253 3.444 10 0 GGAEMO Brc1ccc2[nH+]ccc(N[C@@H]3CCCN(c4ncccn4)C3)c2c1 ZINC000503537788 567492874 /nfs/dbraw/zinc/49/28/74/567492874.db2.gz SMVDZDKHFYSGAS-CQSZACIVSA-N 1 1 384.281 3.290 10 0 GGAEMO CCc1ccc(S(=O)(=O)N(C)C[C@@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000437333668 567493747 /nfs/dbraw/zinc/49/37/47/567493747.db2.gz ORMBUVONKOLKMI-KRWDZBQOSA-N 1 1 378.563 3.453 10 0 GGAEMO COc1ccc(CN2CC[C@@H]([NH2+]Cc3ccsc3Br)C2=O)cc1 ZINC000663299084 567494047 /nfs/dbraw/zinc/49/40/47/567494047.db2.gz DTUIBZCMVYNNBN-OAHLLOKOSA-N 1 1 395.322 3.410 10 0 GGAEMO Brc1cccc2c1CC[N@H+](CCc1nnnn1-c1ccccc1)C2 ZINC000503568099 567495751 /nfs/dbraw/zinc/49/57/51/567495751.db2.gz FYOXSRXRDSZBNG-UHFFFAOYSA-N 1 1 384.281 3.026 10 0 GGAEMO Brc1cccc2c1CC[N@@H+](CCc1nnnn1-c1ccccc1)C2 ZINC000503568099 567495752 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10 0 GGAEMO C[N@H+]1C[C@@H]2CCN(C(=O)CCOc3ccc(Cl)cc3Br)[C@@H]2C1 ZINC000644814332 567580207 /nfs/dbraw/zinc/58/02/07/567580207.db2.gz JOOKBSYJEUCYGQ-SMDDNHRTSA-N 1 1 387.705 3.034 10 0 GGAEMO Cc1cc(SCC(=O)N2CC[C@H]3C[N@H+](C)C[C@@H]32)c(C)cc1Br ZINC000644820139 567580366 /nfs/dbraw/zinc/58/03/66/567580366.db2.gz UQYMDEBRKXANCL-ZFWWWQNUSA-N 1 1 383.355 3.321 10 0 GGAEMO Cc1cc(C(=O)N2CC[C@@H]3C[N@H+](C)C[C@H]32)nn1-c1ccc(Cl)cc1Cl ZINC000644818378 567580893 /nfs/dbraw/zinc/58/08/93/567580893.db2.gz LVVRQLATAYIQLW-SJKOYZFVSA-N 1 1 379.291 3.264 10 0 GGAEMO C[N@H+]1C[C@H]2CCN(C(=O)Cc3csc4ccc(Br)cc34)[C@@H]2C1 ZINC000644820469 567580955 /nfs/dbraw/zinc/58/09/55/567580955.db2.gz WOHDBPHVFQCXPD-IAQYHMDHSA-N 1 1 379.323 3.369 10 0 GGAEMO C[N@H+]1C[C@H]2CCN(C(=O)CCCCOc3ccc(Br)cc3)[C@@H]2C1 ZINC000644822158 567580973 /nfs/dbraw/zinc/58/09/73/567580973.db2.gz OYQPAINGXCVERK-RHSMWYFYSA-N 1 1 381.314 3.161 10 0 GGAEMO C[N@H+]1C[C@@H]2CCN(C(=O)c3cc(Br)sc3Br)[C@@H]2C1 ZINC000644814047 567581017 /nfs/dbraw/zinc/58/10/17/567581017.db2.gz INCRDRAYXYOJML-IONNQARKSA-N 1 1 394.132 3.049 10 0 GGAEMO C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)CCc2nc3cc(Br)ccc3s2)C1 ZINC000644818938 567581308 /nfs/dbraw/zinc/58/13/08/567581308.db2.gz OYSBVLCKEMGGHM-FZMZJTMJSA-N 1 1 394.338 3.154 10 0 GGAEMO CCCOc1c(Br)cc(CN2CC[C@@H]3C[N@@H+](C)C[C@@H]32)cc1OC ZINC000644840511 567581888 /nfs/dbraw/zinc/58/18/88/567581888.db2.gz KPCFUZIRFAJLII-ZBFHGGJFSA-N 1 1 383.330 3.382 10 0 GGAEMO C[N@@H+]1C[C@H]2[C@@H](CCN2Cc2ccc(OC(F)(F)F)c(Br)c2)C1 ZINC000644840282 567582292 /nfs/dbraw/zinc/58/22/92/567582292.db2.gz JUJOBIYXVMXPHX-AAEUAGOBSA-N 1 1 379.220 3.484 10 0 GGAEMO C[N@H+]1C[C@H]2CCN(Cc3ccc(OC(F)(F)F)c(Br)c3)[C@@H]2C1 ZINC000644840283 567582393 /nfs/dbraw/zinc/58/23/93/567582393.db2.gz JUJOBIYXVMXPHX-DGCLKSJQSA-N 1 1 379.220 3.484 10 0 GGAEMO COc1cc(CN2CC[C@@H]3C[N@@H+](C)C[C@@H]32)cc(Br)c1OC(F)F ZINC000644839967 567582538 /nfs/dbraw/zinc/58/25/38/567582538.db2.gz HTTWSUXTRNETMQ-YPMHNXCESA-N 1 1 391.256 3.195 10 0 GGAEMO Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@H]2C[N@H+](C)C[C@H]21 ZINC000644840326 567582665 /nfs/dbraw/zinc/58/26/65/567582665.db2.gz KHCQDWGLKRSAPR-KBXCAEBGSA-N 1 1 375.314 3.079 10 0 GGAEMO Cc1nn(-c2ccc(Br)cc2)cc1CN1CC[C@@H]2C[N@H+](C)C[C@H]21 ZINC000644840329 567582699 /nfs/dbraw/zinc/58/26/99/567582699.db2.gz KHCQDWGLKRSAPR-RDTXWAMCSA-N 1 1 375.314 3.079 10 0 GGAEMO NC(=O)c1c(F)cc(Br)cc1NC[C@@H]1CCC[N@@H+](CC2CC2)C1 ZINC000664679866 567582757 /nfs/dbraw/zinc/58/27/57/567582757.db2.gz WXKQMNNBSVTDGO-LBPRGKRZSA-N 1 1 384.293 3.221 10 0 GGAEMO CCN(C(=O)NCc1ccc(Br)cc1OC)[C@@H]1CC[N@@H+](CC)C1 ZINC000664713744 567584118 /nfs/dbraw/zinc/58/41/18/567584118.db2.gz SLBSWZWDIWNFJP-OAHLLOKOSA-N 1 1 384.318 3.083 10 0 GGAEMO O=C1N[C@H](c2ccc(Br)cc2)C(=O)N1C[C@@H]1CC[N@H+]1C1CCCC1 ZINC000530212591 567584928 /nfs/dbraw/zinc/58/49/28/567584928.db2.gz LEMOXJMQIGDAIO-JKSUJKDBSA-N 1 1 392.297 3.059 10 0 GGAEMO CCN(C(=O)N[C@@H](C)c1ccc(Br)cc1OC)[C@@H]1CC[N@@H+](C)C1 ZINC000664730150 567585698 /nfs/dbraw/zinc/58/56/98/567585698.db2.gz PUVKIWGIDJSKGD-GXTWGEPZSA-N 1 1 384.318 3.254 10 0 GGAEMO Clc1cc(C[N@@H+]2CC[C@H]3COC[C@@H]3C2)ccc1I ZINC000595826664 567585618 /nfs/dbraw/zinc/58/56/18/567585618.db2.gz GLUVJUPYMRFHJL-RYUDHWBXSA-N 1 1 377.653 3.413 10 0 GGAEMO Clc1cc(C[N@H+]2CC[C@H]3COC[C@@H]3C2)ccc1I ZINC000595826664 567585624 /nfs/dbraw/zinc/58/56/24/567585624.db2.gz GLUVJUPYMRFHJL-RYUDHWBXSA-N 1 1 377.653 3.413 10 0 GGAEMO CCOc1cc(C[NH2+][C@@H](CO)c2ccccc2OC)cc(Br)c1O ZINC000571762019 567586319 /nfs/dbraw/zinc/58/63/19/567586319.db2.gz YXXWFRQJGGEXTF-HNNXBMFYSA-N 1 1 396.281 3.385 10 0 GGAEMO COC(=O)[C@H]1C[C@@H]([N@H+](C)Cc2ncc(-c3ccccc3Br)o2)C1 ZINC000595848747 567586347 /nfs/dbraw/zinc/58/63/47/567586347.db2.gz PKNDVCBGOPHWKO-TXEJJXNPSA-N 1 1 379.254 3.488 10 0 GGAEMO COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2ncc(-c3ccccc3Br)o2)C1 ZINC000595848747 567586351 /nfs/dbraw/zinc/58/63/51/567586351.db2.gz PKNDVCBGOPHWKO-TXEJJXNPSA-N 1 1 379.254 3.488 10 0 GGAEMO COC(=O)[C@H]1C[C@@H]([N@H+](C)Cc2coc(-c3ccc(Br)cc3)n2)C1 ZINC000595848003 567586722 /nfs/dbraw/zinc/58/67/22/567586722.db2.gz KQJCTBRGKBTFIL-JNSHFYNHSA-N 1 1 379.254 3.488 10 0 GGAEMO COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2coc(-c3ccc(Br)cc3)n2)C1 ZINC000595848003 567586731 /nfs/dbraw/zinc/58/67/31/567586731.db2.gz KQJCTBRGKBTFIL-JNSHFYNHSA-N 1 1 379.254 3.488 10 0 GGAEMO COC(=O)[C@H]1C[C@@H]([N@H+](C)CC(=O)Nc2c(Cl)cc(Cl)cc2Cl)C1 ZINC000595851057 567587001 /nfs/dbraw/zinc/58/70/01/567587001.db2.gz TZZWKTDIMWMHLK-WAAGHKOSSA-N 1 1 379.671 3.469 10 0 GGAEMO COC(=O)[C@H]1C[C@@H]([N@@H+](C)CC(=O)Nc2c(Cl)cc(Cl)cc2Cl)C1 ZINC000595851057 567587007 /nfs/dbraw/zinc/58/70/07/567587007.db2.gz TZZWKTDIMWMHLK-WAAGHKOSSA-N 1 1 379.671 3.469 10 0 GGAEMO CC[C@@H]1CN(C)CC[N@H+]1CCCOc1cccc(I)c1 ZINC000552397508 567587387 /nfs/dbraw/zinc/58/73/87/567587387.db2.gz GMMASOXLCRAMJR-OAHLLOKOSA-N 1 1 388.293 3.086 10 0 GGAEMO CC[C@@H]1C[N@H+](C)CCN1CCCOc1cccc(I)c1 ZINC000552397508 567587394 /nfs/dbraw/zinc/58/73/94/567587394.db2.gz GMMASOXLCRAMJR-OAHLLOKOSA-N 1 1 388.293 3.086 10 0 GGAEMO CC[C@@H]1C[N@@H+](C)CCN1CCCOc1cccc(I)c1 ZINC000552397508 567587401 /nfs/dbraw/zinc/58/74/01/567587401.db2.gz GMMASOXLCRAMJR-OAHLLOKOSA-N 1 1 388.293 3.086 10 0 GGAEMO CO[C@@H](C)C[N@@H+](C[C@H](O)COc1cc(F)cc(Br)c1)C(C)C ZINC000439443170 567587562 /nfs/dbraw/zinc/58/75/62/567587562.db2.gz AAXVZEPRWKQISJ-WFASDCNBSA-N 1 1 378.282 3.073 10 0 GGAEMO C[C@H](O)C[N@H+]1CCN(c2nnc(-c3cc(Cl)cc(Cl)c3)s2)[C@@H](C)C1 ZINC000480197956 567587747 /nfs/dbraw/zinc/58/77/47/567587747.db2.gz HSOURFCNVXKOMT-QWRGUYRKSA-N 1 1 387.336 3.403 10 0 GGAEMO CCN(C(=O)N[C@H]1CSc2ccc(Br)cc21)[C@H]1CC[N@@H+](C)C1 ZINC000664773545 567588095 /nfs/dbraw/zinc/58/80/95/567588095.db2.gz UVFQCSDCJQMONX-JSGCOSHPSA-N 1 1 384.343 3.332 10 0 GGAEMO CCN(C(=O)N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)[C@H]1CC[N@@H+](C)C1 ZINC000664785169 567589643 /nfs/dbraw/zinc/58/96/43/567589643.db2.gz HUCWSNQEAHIELU-HEHGZKQESA-N 1 1 384.293 3.180 10 0 GGAEMO CN(C(=O)NC/C=C\c1ccc(Br)cc1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000458974366 567591391 /nfs/dbraw/zinc/59/13/91/567591391.db2.gz NHCFLMFMZLHOSX-KYVUIXNKSA-N 1 1 378.314 3.340 10 0 GGAEMO Cn1cc(C(=O)Nc2ccc(C[NH+](C)C)c(Br)c2)c(C(F)F)n1 ZINC000530323220 567591798 /nfs/dbraw/zinc/59/17/98/567591798.db2.gz PDKXOALOUDVHAN-UHFFFAOYSA-N 1 1 387.228 3.434 10 0 GGAEMO CN(C(=O)NC/C=C/c1ccc(Br)cc1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000458974371 567591868 /nfs/dbraw/zinc/59/18/68/567591868.db2.gz NHCFLMFMZLHOSX-YATRRXNKSA-N 1 1 378.314 3.340 10 0 GGAEMO CCN(C(=O)N[C@@H]1CCOc2c(Br)cccc21)[C@H]1CC[N@@H+](C)C1 ZINC000664823750 567592012 /nfs/dbraw/zinc/59/20/12/567592012.db2.gz JUZQTKYSURQUKT-SWLSCSKDSA-N 1 1 382.302 3.008 10 0 GGAEMO CCN(C(=O)N[C@@H]1CCOc2c(Br)cccc21)[C@@H]1CC[N@@H+](CC)C1 ZINC000664822734 567592358 /nfs/dbraw/zinc/59/23/58/567592358.db2.gz BSEMJFPQFXUCMV-CZUORRHYSA-N 1 1 396.329 3.398 10 0 GGAEMO C[C@@H](N(C)C(=O)c1sc2c(c1I)C[NH2+]C2)C(C)(C)C ZINC000595928700 567592657 /nfs/dbraw/zinc/59/26/57/567592657.db2.gz DZIDLPSAHLXODK-MRVPVSSYSA-N 1 1 392.306 3.463 10 0 GGAEMO C[C@@H]1CCC[C@@H](NC(=O)c2sc3c(c2I)C[NH2+]C3)C1 ZINC000595926043 567592736 /nfs/dbraw/zinc/59/27/36/567592736.db2.gz BNQMIJSBKYRYLE-RKDXNWHRSA-N 1 1 390.290 3.264 10 0 GGAEMO C[C@H]1CCC[C@@H](NC(=O)c2sc3c(c2I)C[NH2+]C3)C1 ZINC000595926041 567592966 /nfs/dbraw/zinc/59/29/66/567592966.db2.gz BNQMIJSBKYRYLE-DTWKUNHWSA-N 1 1 390.290 3.264 10 0 GGAEMO CC(C)[C@H]1CCCN1C(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595929822 567593302 /nfs/dbraw/zinc/59/33/02/567593302.db2.gz ZGIKWZBJFAMIID-SNVBAGLBSA-N 1 1 390.290 3.217 10 0 GGAEMO C[N@H+]1CCC[C@H](NC(=O)N2CC[C@@H](Cc3ccc(Br)cc3)C2)C1 ZINC000644943369 567593261 /nfs/dbraw/zinc/59/32/61/567593261.db2.gz JWNXCPWEZOPHIU-RDJZCZTQSA-N 1 1 380.330 3.117 10 0 GGAEMO CCN(C(=O)NCC(F)(F)c1ccc(Br)cc1)[C@@H]1CC[N@@H+](C)C1 ZINC000621553418 567593429 /nfs/dbraw/zinc/59/34/29/567593429.db2.gz ZWCYRKQDENKTDG-CQSZACIVSA-N 1 1 390.272 3.277 10 0 GGAEMO CCN(C(=O)N[C@H](c1cncc(Br)c1)C1CC1)[C@H]1CC[N@@H+](C)C1 ZINC000664849562 567593947 /nfs/dbraw/zinc/59/39/47/567593947.db2.gz BVHLKXQFUIFCSB-HOTGVXAUSA-N 1 1 381.318 3.031 10 0 GGAEMO CCC(C)(CC)NC(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595934576 567594220 /nfs/dbraw/zinc/59/42/20/567594220.db2.gz OWJBVBSTOMZMRX-UHFFFAOYSA-N 1 1 378.279 3.264 10 0 GGAEMO C[C@@H]1C[C@@H](C)CN(C(=O)c2sc3c(c2I)C[NH2+]C3)C1 ZINC000595931821 567594305 /nfs/dbraw/zinc/59/43/05/567594305.db2.gz YURRIPFVAZGWSZ-RKDXNWHRSA-N 1 1 390.290 3.074 10 0 GGAEMO CCCC(C)(C)NC(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595932716 567594362 /nfs/dbraw/zinc/59/43/62/567594362.db2.gz QCGWWAGHQPARQI-UHFFFAOYSA-N 1 1 378.279 3.264 10 0 GGAEMO O=C(c1sc2c(c1I)C[NH2+]C2)N1Cc2ccccc2C1 ZINC000595935285 567594387 /nfs/dbraw/zinc/59/43/87/567594387.db2.gz INIBRAJOFRVVGP-UHFFFAOYSA-N 1 1 396.253 3.112 10 0 GGAEMO CC1(C)CCC[C@@H]1NC(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595949670 567594417 /nfs/dbraw/zinc/59/44/17/567594417.db2.gz ZLESDXXJSXKZOB-JTQLQIEISA-N 1 1 390.290 3.264 10 0 GGAEMO C[C@@H]1CC[C@@H](C)N(C(=O)c2sc3c(c2I)C[NH2+]C3)C1 ZINC000595941170 567594557 /nfs/dbraw/zinc/59/45/57/567594557.db2.gz AFETUBOYVLCANR-RKDXNWHRSA-N 1 1 390.290 3.217 10 0 GGAEMO CC1(C)CCC[C@H]1NC(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595949671 567594625 /nfs/dbraw/zinc/59/46/25/567594625.db2.gz ZLESDXXJSXKZOB-SNVBAGLBSA-N 1 1 390.290 3.264 10 0 GGAEMO C[C@@H]1CCCN(C(=O)c2sc3c(c2I)C[NH2+]C3)CC1 ZINC000595931916 567594772 /nfs/dbraw/zinc/59/47/72/567594772.db2.gz JYORUOFIVXNNAQ-SECBINFHSA-N 1 1 390.290 3.218 10 0 GGAEMO CC[C@@H](C)[C@@H](C)NC(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595933362 567594822 /nfs/dbraw/zinc/59/48/22/567594822.db2.gz WQQLLYPQZIVVMJ-HTQZYQBOSA-N 1 1 378.279 3.120 10 0 GGAEMO CCC1(NC(=O)c2sc3c(c2I)C[NH2+]C3)CCC1 ZINC000595943205 567594841 /nfs/dbraw/zinc/59/48/41/567594841.db2.gz HKFXGWCUJYCTON-UHFFFAOYSA-N 1 1 376.263 3.018 10 0 GGAEMO CCN(C(=O)N[C@@H](c1cncc(Br)c1)C1CC1)[C@H]1CC[N@@H+](CC)C1 ZINC000664850175 567594917 /nfs/dbraw/zinc/59/49/17/567594917.db2.gz IJQGBCTZNRUKKS-DLBZAZTESA-N 1 1 395.345 3.421 10 0 GGAEMO C[C@@H]1[C@@H](C)CCCN1C(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595932893 567594946 /nfs/dbraw/zinc/59/49/46/567594946.db2.gz REHILMFYSLIGGI-DTWKUNHWSA-N 1 1 390.290 3.217 10 0 GGAEMO CC[C@@]1(C)CCN(C(=O)c2sc3c(c2I)C[NH2+]C3)C1 ZINC000595938851 567595156 /nfs/dbraw/zinc/59/51/56/567595156.db2.gz QFFRXEJFZJAMEW-AWEZNQCLSA-N 1 1 390.290 3.218 10 0 GGAEMO COC(=O)c1ccc(C)c(NC(=O)c2sc3c(c2Br)C[NH2+]C3)c1 ZINC000595931822 567595211 /nfs/dbraw/zinc/59/52/11/567595211.db2.gz YXTSXURXZARJSW-UHFFFAOYSA-N 1 1 395.278 3.461 10 0 GGAEMO CCN(C(=O)N[C@H](c1cncc(Br)c1)C1CC1)[C@@H]1CC[N@@H+](CC)C1 ZINC000664850178 567595355 /nfs/dbraw/zinc/59/53/55/567595355.db2.gz IJQGBCTZNRUKKS-SJORKVTESA-N 1 1 395.345 3.421 10 0 GGAEMO CN(CCC(C)(C)C)C(=O)c1sc2c(c1I)C[NH2+]C2 ZINC000595955650 567596118 /nfs/dbraw/zinc/59/61/18/567596118.db2.gz CNBLBGMFAAPWLB-UHFFFAOYSA-N 1 1 392.306 3.464 10 0 GGAEMO C[C@@H](NC(=O)c1sc2c(c1I)C[NH2+]C2)C(C)(C)C ZINC000595959365 567596189 /nfs/dbraw/zinc/59/61/89/567596189.db2.gz OSEVPTCDGFQGMA-SSDOTTSWSA-N 1 1 378.279 3.120 10 0 GGAEMO O=C(Cc1cscc1Br)Nc1cccc(C[N@@H+]2CC[C@@H](O)C2)c1 ZINC000552550126 567596224 /nfs/dbraw/zinc/59/62/24/567596224.db2.gz LHRMCAWYUCNGGT-OAHLLOKOSA-N 1 1 395.322 3.258 10 0 GGAEMO CCN(C(=O)NCc1cc(F)c(F)cc1Br)[C@@H]1CC[N@@H+](CC)C1 ZINC000664887543 567598068 /nfs/dbraw/zinc/59/80/68/567598068.db2.gz UKDZNCGIPKWSNJ-GFCCVEGCSA-N 1 1 390.272 3.353 10 0 GGAEMO CN(C(=O)N[C@@H]1CCc2c1ccc(F)c2Br)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000459070727 567598354 /nfs/dbraw/zinc/59/83/54/567598354.db2.gz RRNJAXCQSYVNAT-MLGOLLRUSA-N 1 1 396.304 3.454 10 0 GGAEMO CCN(C(=O)N[C@H]1C[C@H](c2ccc(Br)cc2)C1)[C@@H]1CC[N@@H+](C)C1 ZINC000664938136 567599826 /nfs/dbraw/zinc/59/98/26/567599826.db2.gz MJPGLRANUSEYEB-DJIMGWMZSA-N 1 1 380.330 3.431 10 0 GGAEMO COCC[N@H+]1CCCN(C(=O)c2cc(C)c(Br)c(Cl)c2)CC1 ZINC000571943860 567601424 /nfs/dbraw/zinc/60/14/24/567601424.db2.gz HNESFYOPSDVCTA-UHFFFAOYSA-N 1 1 389.721 3.205 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)C(=O)NCCc2cccc(Br)c2)[C@H](C)C1 ZINC000459146826 567601612 /nfs/dbraw/zinc/60/16/12/567601612.db2.gz JFUWRBUAHLLQDH-PBHICJAKSA-N 1 1 382.346 3.363 10 0 GGAEMO CCN(C(=O)NCCC(=O)Nc1cc(Cl)cc(Cl)c1)[C@H]1CC[N@@H+](C)C1 ZINC000664968593 567602960 /nfs/dbraw/zinc/60/29/60/567602960.db2.gz RTPKGOOQJNAPAN-HNNXBMFYSA-N 1 1 387.311 3.058 10 0 GGAEMO COc1nc(C)cc(C)c1CN(C)C(=O)[C@@H]([NH3+])c1ccccc1Br ZINC000621678571 567603454 /nfs/dbraw/zinc/60/34/54/567603454.db2.gz XSIKHXBNZPBOII-INIZCTEOSA-N 1 1 392.297 3.128 10 0 GGAEMO CC(C)[N@@H+](C)CC(=O)N1CCC[C@H]1c1ccccc1I ZINC000505960753 567605029 /nfs/dbraw/zinc/60/50/29/567605029.db2.gz YPTCRGOKJFIKNW-HNNXBMFYSA-N 1 1 386.277 3.295 10 0 GGAEMO CCN(C(=O)N[C@H]1CCc2c1ccc(F)c2Br)[C@@H]1CC[N@@H+](C)C1 ZINC000665040715 567606475 /nfs/dbraw/zinc/60/64/75/567606475.db2.gz UFMLSCYFQSBBKA-ABAIWWIYSA-N 1 1 384.293 3.311 10 0 GGAEMO CCN(C(=O)N[C@H]1CCc2c1ccc(F)c2Br)[C@H]1CC[N@@H+](C)C1 ZINC000665040724 567606601 /nfs/dbraw/zinc/60/66/01/567606601.db2.gz UFMLSCYFQSBBKA-NHYWBVRUSA-N 1 1 384.293 3.311 10 0 GGAEMO COC(=O)[C@](C)(O)C[NH2+][C@H](C)c1nc(-c2ccc(Br)cc2)cs1 ZINC000572022391 567606894 /nfs/dbraw/zinc/60/68/94/567606894.db2.gz ZAAZKWNIAKZPDM-QLJPJBMISA-N 1 1 399.310 3.147 10 0 GGAEMO CNC(=O)[C@@H](C)Oc1ccc(Br)cc1C[NH+]1CC(CC2CC2)C1 ZINC000621740491 567608354 /nfs/dbraw/zinc/60/83/54/567608354.db2.gz SYQZXETYJKVGKQ-GFCCVEGCSA-N 1 1 381.314 3.194 10 0 GGAEMO CN1CCC[N@@H+](CCCN[C@@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621751355 567608372 /nfs/dbraw/zinc/60/83/72/567608372.db2.gz FFXYJLGTRRAFOQ-INIZCTEOSA-N 1 1 390.316 3.373 10 0 GGAEMO C[N@@H+]1CCCN(CCCN[C@@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621751355 567608380 /nfs/dbraw/zinc/60/83/80/567608380.db2.gz FFXYJLGTRRAFOQ-INIZCTEOSA-N 1 1 390.316 3.373 10 0 GGAEMO C[N@H+]1CCCN(CCCN[C@@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621751355 567608390 /nfs/dbraw/zinc/60/83/90/567608390.db2.gz FFXYJLGTRRAFOQ-INIZCTEOSA-N 1 1 390.316 3.373 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CN[C@@H](c1ccc(Br)cc1)C(F)F ZINC000621752313 567608810 /nfs/dbraw/zinc/60/88/10/567608810.db2.gz XUXRABSCPDCKHL-GJZGRUSLSA-N 1 1 377.273 3.456 10 0 GGAEMO CCOc1cc(CN2CC[C@H]3C[NH2+]C[C@H]3CC2)cc(Br)c1OC ZINC000572038566 567608981 /nfs/dbraw/zinc/60/89/81/567608981.db2.gz MCPQVVCJNGCCHE-GASCZTMLSA-N 1 1 383.330 3.288 10 0 GGAEMO CN(C)CC[NH+]1CCC(N[C@@H](c2ccc(Br)cc2)C(F)F)CC1 ZINC000621750211 567609149 /nfs/dbraw/zinc/60/91/49/567609149.db2.gz KYZAODQFFQLDQN-INIZCTEOSA-N 1 1 390.316 3.371 10 0 GGAEMO C[N@H+]1CCN(CCN[C@H](c2ccc(Br)cc2)C(F)F)CC1(C)C ZINC000621761875 567609733 /nfs/dbraw/zinc/60/97/33/567609733.db2.gz OTCXEVULKSJJCN-OAHLLOKOSA-N 1 1 390.316 3.371 10 0 GGAEMO CSc1c(C(=O)Nc2ccc(C[NH+](C)C)c(Br)c2)cnn1C ZINC000480515761 567609963 /nfs/dbraw/zinc/60/99/63/567609963.db2.gz ZPZPUQCMIPNFBE-UHFFFAOYSA-N 1 1 383.315 3.218 10 0 GGAEMO OCCC[N@H+]1CCC[C@@H]1CN[C@H](c1ccc(Br)cc1)C(F)F ZINC000621763471 567610355 /nfs/dbraw/zinc/61/03/55/567610355.db2.gz YHVLWFQNTOZLFW-HUUCEWRRSA-N 1 1 377.273 3.192 10 0 GGAEMO OCCC[N@H+]1CCC[C@@H]1CN[C@@H](c1ccc(Br)cc1)C(F)F ZINC000621763469 567610540 /nfs/dbraw/zinc/61/05/40/567610540.db2.gz YHVLWFQNTOZLFW-CABCVRRESA-N 1 1 377.273 3.192 10 0 GGAEMO COC(=O)[C@@H]1CC12CC[NH+](Cc1nc3ccc(Br)cc3[nH]1)CC2 ZINC000480561897 567612543 /nfs/dbraw/zinc/61/25/43/567612543.db2.gz ZJQMKRRGKAGLNH-LBPRGKRZSA-N 1 1 378.270 3.101 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)NCc1cc(F)c(F)cc1Br ZINC000506164203 567613471 /nfs/dbraw/zinc/61/34/71/567613471.db2.gz PNXNLUFXNIUFNC-LLVKDONJSA-N 1 1 390.272 3.401 10 0 GGAEMO Cc1ncsc1CCNC(=O)N[C@@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000572111455 567614086 /nfs/dbraw/zinc/61/40/86/567614086.db2.gz CVSJYCLWEDQGFT-WBVHZDCISA-N 1 1 378.929 3.392 10 0 GGAEMO Cc1ncsc1CCNC(=O)N[C@@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000572111455 567614090 /nfs/dbraw/zinc/61/40/90/567614090.db2.gz CVSJYCLWEDQGFT-WBVHZDCISA-N 1 1 378.929 3.392 10 0 GGAEMO Cn1cc(C[C@@H]2CC[N@@H+](C[C@H](O)COc3c(Cl)cccc3Cl)C2)cn1 ZINC000530627039 567614940 /nfs/dbraw/zinc/61/49/40/567614940.db2.gz BEFLVNBKEXJJRB-ZFWWWQNUSA-N 1 1 384.307 3.031 10 0 GGAEMO Cn1cc(C[C@H]2CC[N@@H+](C[C@H](O)COc3c(Cl)cccc3Cl)C2)cn1 ZINC000530627037 567615336 /nfs/dbraw/zinc/61/53/36/567615336.db2.gz BEFLVNBKEXJJRB-HIFRSBDPSA-N 1 1 384.307 3.031 10 0 GGAEMO CC[C@H](NC(=O)C(=O)Nc1ccc(Cl)c(C[NH+](C)C)c1)c1nccs1 ZINC000440079586 567615959 /nfs/dbraw/zinc/61/59/59/567615959.db2.gz YXWGWGNSTLFDTB-AWEZNQCLSA-N 1 1 380.901 3.064 10 0 GGAEMO C[N@@H+](Cc1cccc(O)c1Br)C[C@@H]1CCCN1c1cccnn1 ZINC000459340487 567617362 /nfs/dbraw/zinc/61/73/62/567617362.db2.gz VKBCIOIOAWSCIL-AWEZNQCLSA-N 1 1 377.286 3.046 10 0 GGAEMO Cn1cncc1CC[N@H+]1CCC[C@H]1c1ccc(I)cc1 ZINC000459363570 567619065 /nfs/dbraw/zinc/61/90/65/567619065.db2.gz RLZHFGVVWVZZIM-INIZCTEOSA-N 1 1 381.261 3.404 10 0 GGAEMO COC(=O)c1cc(Cl)cc(Cl)c1N1CCC([N@H+]2CCCOCC2)CC1 ZINC000596268420 567619694 /nfs/dbraw/zinc/61/96/94/567619694.db2.gz KFTYBECFDURXIT-UHFFFAOYSA-N 1 1 387.307 3.471 10 0 GGAEMO Brc1ccc(C[NH2+][C@H](CN2CCOCC2)c2ccccc2)nc1 ZINC000506294700 567620998 /nfs/dbraw/zinc/62/09/98/567620998.db2.gz ZBNQIOYLAFPFAT-GOSISDBHSA-N 1 1 376.298 3.007 10 0 GGAEMO CC(C)[C@H](NCC(F)(F)F)C(=O)NC[C@H](c1ccccc1Cl)[NH+](C)C ZINC000665387304 567623006 /nfs/dbraw/zinc/62/30/06/567623006.db2.gz LNZPAFRPEYMWEX-CABCVRRESA-N 1 1 379.854 3.235 10 0 GGAEMO Cc1c(Cl)cc(F)c(NC(=O)N(C)CCC[N@H+](C)CCN(C)C)c1F ZINC000459457002 567625471 /nfs/dbraw/zinc/62/54/71/567625471.db2.gz HZLMOASZERZXOM-UHFFFAOYSA-N 1 1 376.879 3.274 10 0 GGAEMO Cc1c(Cl)cc(F)c(NC(=O)N(C)CCCN(C)CC[NH+](C)C)c1F ZINC000459457002 567625475 /nfs/dbraw/zinc/62/54/75/567625475.db2.gz HZLMOASZERZXOM-UHFFFAOYSA-N 1 1 376.879 3.274 10 0 GGAEMO CCC[N@@H+](C[C@H](O)COc1ccc(Br)cc1)C[C@@H]1CCCCO1 ZINC000553080228 567625727 /nfs/dbraw/zinc/62/57/27/567625727.db2.gz YMVKLFWSUFXCMT-WMZOPIPTSA-N 1 1 386.330 3.470 10 0 GGAEMO O=C1CCCN1CC[N@H+]1CCC[C@H]1c1ccccc1I ZINC000506467716 567626582 /nfs/dbraw/zinc/62/65/82/567626582.db2.gz AQCWNZIPHQQHTG-HNNXBMFYSA-N 1 1 384.261 3.051 10 0 GGAEMO O=C1CCCN1CC[N@@H+]1CCC[C@H]1c1ccccc1I ZINC000506467716 567626588 /nfs/dbraw/zinc/62/65/88/567626588.db2.gz AQCWNZIPHQQHTG-HNNXBMFYSA-N 1 1 384.261 3.051 10 0 GGAEMO CC[N@@H+]1CCc2nc(NC(=O)c3cncc(Br)c3C)sc2C1 ZINC000665548168 567629006 /nfs/dbraw/zinc/62/90/06/567629006.db2.gz NCBRPCUXGQVZJF-UHFFFAOYSA-N 1 1 381.299 3.239 10 0 GGAEMO CC[N@H+]1CCc2nc(NC(=O)c3cncc(Br)c3C)sc2C1 ZINC000665548168 567629009 /nfs/dbraw/zinc/62/90/09/567629009.db2.gz NCBRPCUXGQVZJF-UHFFFAOYSA-N 1 1 381.299 3.239 10 0 GGAEMO CC(C)C[N@H+]1CCO[C@H](CNC(=O)CSCc2ccsc2Cl)C1 ZINC000596394660 567629219 /nfs/dbraw/zinc/62/92/19/567629219.db2.gz VXEWKWKKXLDKMI-CQSZACIVSA-N 1 1 376.975 3.108 10 0 GGAEMO Cn1cncc1CC[N@H+]1CC[C@H](Cc2cccc(I)c2)C1 ZINC000459491751 567629289 /nfs/dbraw/zinc/62/92/89/567629289.db2.gz VGTWQXBZGMZHGU-OAHLLOKOSA-N 1 1 395.288 3.132 10 0 GGAEMO CC(C)C[N@H+]1CCO[C@@H](CNC(=O)CSCc2ccsc2Cl)C1 ZINC000596394654 567629380 /nfs/dbraw/zinc/62/93/80/567629380.db2.gz VXEWKWKKXLDKMI-AWEZNQCLSA-N 1 1 376.975 3.108 10 0 GGAEMO CC(C)C[N@H+]1CCO[C@@H](CNC(=O)CSC[C@@H]2CCCCC2(F)F)C1 ZINC000596397845 567629648 /nfs/dbraw/zinc/62/96/48/567629648.db2.gz YDMOQNAIFVKDHU-HOTGVXAUSA-N 1 1 378.529 3.018 10 0 GGAEMO Cn1cncc1CC[N@H+]1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000459491749 567629814 /nfs/dbraw/zinc/62/98/14/567629814.db2.gz VGTWQXBZGMZHGU-HNNXBMFYSA-N 1 1 395.288 3.132 10 0 GGAEMO CC(C)OC[C@@H](O)C[N@H+]1CCC[C@@H]1c1ccccc1I ZINC000506597385 567632278 /nfs/dbraw/zinc/63/22/78/567632278.db2.gz VJABKZMFHKHQMT-XJKSGUPXSA-N 1 1 389.277 3.214 10 0 GGAEMO Cc1cc(C(=O)NCC[N@@H+]2CC[C@H](C)C2)nn1-c1ccc(Br)cc1 ZINC000530949590 567633060 /nfs/dbraw/zinc/63/30/60/567633060.db2.gz YXIYXSYMNUSNID-ZDUSSCGKSA-N 1 1 391.313 3.015 10 0 GGAEMO CCOc1cc(C[N@H+](CCO)Cc2ccc(C)o2)cc(Br)c1O ZINC000459522160 567634331 /nfs/dbraw/zinc/63/43/31/567634331.db2.gz HRNLFGBNNAVKQK-UHFFFAOYSA-N 1 1 384.270 3.449 10 0 GGAEMO CCOc1cc(C[N@@H+](CCO)Cc2ccc(C)o2)cc(Br)c1O ZINC000459522160 567634335 /nfs/dbraw/zinc/63/43/35/567634335.db2.gz HRNLFGBNNAVKQK-UHFFFAOYSA-N 1 1 384.270 3.449 10 0 GGAEMO CCOc1cc(CN2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)cc(Br)c1O ZINC000459550644 567635133 /nfs/dbraw/zinc/63/51/33/567635133.db2.gz KKHXLWMFJHXOHO-ZBFHGGJFSA-N 1 1 383.330 3.470 10 0 GGAEMO CCOc1cc(CN2CCC[C@H]3C[N@@H+](C)CC[C@@H]32)cc(Br)c1O ZINC000459550643 567636027 /nfs/dbraw/zinc/63/60/27/567636027.db2.gz KKHXLWMFJHXOHO-HOCLYGCPSA-N 1 1 383.330 3.470 10 0 GGAEMO CC1=CC[N@@H+](CCNC(=O)CSCc2cc(-c3cccs3)on2)CC1 ZINC000506654819 567637080 /nfs/dbraw/zinc/63/70/80/567637080.db2.gz QHJFVMIOGHWXNX-UHFFFAOYSA-N 1 1 377.535 3.405 10 0 GGAEMO CCOc1cc(C[N@@H+]2CCC[C@H](CCNC(C)=O)C2)cc(Br)c1O ZINC000459560180 567637341 /nfs/dbraw/zinc/63/73/41/567637341.db2.gz LHUPAKNELSJERK-CQSZACIVSA-N 1 1 399.329 3.292 10 0 GGAEMO CCOc1cc(C[N@H+]2CCC[C@H](CCNC(C)=O)C2)cc(Br)c1O ZINC000459560180 567637346 /nfs/dbraw/zinc/63/73/46/567637346.db2.gz LHUPAKNELSJERK-CQSZACIVSA-N 1 1 399.329 3.292 10 0 GGAEMO OC[C@@]1(O)CCCN(c2cc(C3CC3)[nH+]c3c(Br)cccc23)C1 ZINC000665732206 567637550 /nfs/dbraw/zinc/63/75/50/567637550.db2.gz QKKGPCNKQOBORX-GOSISDBHSA-N 1 1 377.282 3.198 10 0 GGAEMO CCOc1cc(C[N@@H+]2CC[C@H]([C@@H](O)C(F)(F)F)C2)cc(Br)c1O ZINC000459579553 567639379 /nfs/dbraw/zinc/63/93/79/567639379.db2.gz ZBONUSJQBMEKQF-IINYFYTJSA-N 1 1 398.219 3.299 10 0 GGAEMO CCOc1cc(C[N@H+]2CC[C@H]([C@@H](O)C(F)(F)F)C2)cc(Br)c1O ZINC000459579553 567639382 /nfs/dbraw/zinc/63/93/82/567639382.db2.gz ZBONUSJQBMEKQF-IINYFYTJSA-N 1 1 398.219 3.299 10 0 GGAEMO CCOc1cc(CN2CC[N@H+](C3CC3)C[C@@H](C)C2)cc(Br)c1O ZINC000459573134 567640045 /nfs/dbraw/zinc/64/00/45/567640045.db2.gz RPWTWPZQEOSCCI-ZDUSSCGKSA-N 1 1 383.330 3.470 10 0 GGAEMO CCOc1cc(C[N@@H+]2CC[C@H]([C@H](O)C(F)(F)F)C2)cc(Br)c1O ZINC000459579552 567640082 /nfs/dbraw/zinc/64/00/82/567640082.db2.gz ZBONUSJQBMEKQF-HZMBPMFUSA-N 1 1 398.219 3.299 10 0 GGAEMO CCOc1cc(C[N@H+]2CC[C@H]([C@H](O)C(F)(F)F)C2)cc(Br)c1O ZINC000459579552 567640089 /nfs/dbraw/zinc/64/00/89/567640089.db2.gz ZBONUSJQBMEKQF-HZMBPMFUSA-N 1 1 398.219 3.299 10 0 GGAEMO CCN(C(=O)Nc1cc(Cl)ccc1N1CCSCC1)[C@@H]1CC[N@@H+](C)C1 ZINC000665913086 567642944 /nfs/dbraw/zinc/64/29/44/567642944.db2.gz BFZFGJXTCRERKP-OAHLLOKOSA-N 1 1 382.961 3.451 10 0 GGAEMO COc1c(Cl)cc(NC(=O)N2CCC([N@H+]3CC[C@H](O)C3)CC2)cc1Cl ZINC000665927665 567644147 /nfs/dbraw/zinc/64/41/47/567644147.db2.gz XORFWKCPDKGYDJ-ZDUSSCGKSA-N 1 1 388.295 3.065 10 0 GGAEMO C[NH+](C)[C@H](CNS(=O)(=O)N1CCC2(CCCCC2)CC1)c1cccs1 ZINC000480939331 567644594 /nfs/dbraw/zinc/64/45/94/567644594.db2.gz XGVMRPDHBIUUPT-MRXNPFEDSA-N 1 1 385.599 3.232 10 0 GGAEMO C[NH+](C)[C@H](CNS(=O)(=O)CCCC1CCOCC1)c1ccc(Cl)cc1 ZINC000645575417 567644621 /nfs/dbraw/zinc/64/46/21/567644621.db2.gz MJVAHFRUFLNKAZ-GOSISDBHSA-N 1 1 388.961 3.069 10 0 GGAEMO COc1c(Cl)cc(NC(=O)N2CCC([N@H+]3CC[C@@H](O)C3)CC2)cc1Cl ZINC000665927660 567644726 /nfs/dbraw/zinc/64/47/26/567644726.db2.gz XORFWKCPDKGYDJ-CYBMUJFWSA-N 1 1 388.295 3.065 10 0 GGAEMO CC[N@@H+]1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)n2)[C@H](C)C1 ZINC000553330615 567644964 /nfs/dbraw/zinc/64/49/64/567644964.db2.gz GFJHTVZXOXHAGB-CQSZACIVSA-N 1 1 391.313 3.109 10 0 GGAEMO CC[N@H+]1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)n2)[C@H](C)C1 ZINC000553330615 567644965 /nfs/dbraw/zinc/64/49/65/567644965.db2.gz GFJHTVZXOXHAGB-CQSZACIVSA-N 1 1 391.313 3.109 10 0 GGAEMO Cc1nc(-c2ccc(S(=O)(=O)NCC[N@H+]3CCCC[C@H]3C)s2)cs1 ZINC000480954026 567645066 /nfs/dbraw/zinc/64/50/66/567645066.db2.gz MADAHJDIYNKQDE-GFCCVEGCSA-N 1 1 385.580 3.333 10 0 GGAEMO Cc1nc(-c2ccc(S(=O)(=O)NCC[N@@H+]3CCCC[C@H]3C)s2)cs1 ZINC000480954026 567645071 /nfs/dbraw/zinc/64/50/71/567645071.db2.gz MADAHJDIYNKQDE-GFCCVEGCSA-N 1 1 385.580 3.333 10 0 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ZINC000507779577 567705709 /nfs/dbraw/zinc/70/57/09/567705709.db2.gz PUGTWGMZVABKJK-HNNXBMFYSA-N 1 1 382.302 3.008 10 0 GGAEMO C[C@H](N[C@H]1C[N@@H+](Cc2ccccc2)C[C@H]1C)c1ncc(Br)cn1 ZINC000573344263 567706117 /nfs/dbraw/zinc/70/61/17/567706117.db2.gz QAHIBVHWVDISRG-KEYYUXOJSA-N 1 1 375.314 3.410 10 0 GGAEMO O=C(NCCc1ccc(Br)s1)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000623382494 567706562 /nfs/dbraw/zinc/70/65/62/567706562.db2.gz IARUPBBGDOUXOH-ZDUSSCGKSA-N 1 1 386.359 3.369 10 0 GGAEMO CN1CC[C@@H]([NH2+]CCCNC(=O)c2cccc(Br)c2)CC1(C)C ZINC000623392529 567706619 /nfs/dbraw/zinc/70/66/19/567706619.db2.gz GVUXMOQBUUVEQU-MRXNPFEDSA-N 1 1 382.346 3.031 10 0 GGAEMO CN1CC[C@@H]([NH2+]CCCNC(=O)c2ccc(Br)cc2)CC1(C)C ZINC000623396448 567707808 /nfs/dbraw/zinc/70/78/08/567707808.db2.gz SKAXCBAGHYHESP-MRXNPFEDSA-N 1 1 382.346 3.031 10 0 GGAEMO CN(Cc1ccccc1Br)C(=O)CC[NH2+][C@@H]1CCN(C)C(C)(C)C1 ZINC000623412881 567709340 /nfs/dbraw/zinc/70/93/40/567709340.db2.gz BBOWOFOAXQBJQV-MRXNPFEDSA-N 1 1 396.373 3.260 10 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/nfs/dbraw/zinc/71/06/23/567710623.db2.gz FUNBZHMJINNABR-AWEZNQCLSA-N 1 1 378.318 3.197 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)N[C@H](C)C[N@H+]1CCC[C@H](C)C1 ZINC000460952043 567712042 /nfs/dbraw/zinc/71/20/42/567712042.db2.gz AESSRRQWGRNRFU-UONOGXRCSA-N 1 1 383.330 3.237 10 0 GGAEMO O=C(N1CC(C[NH+]2CCOCC2)C1)C1(c2ccc(Cl)c(Cl)c2)CCC1 ZINC000646357468 567712118 /nfs/dbraw/zinc/71/21/18/567712118.db2.gz WYJHASIYILPRMI-UHFFFAOYSA-N 1 1 383.319 3.206 10 0 GGAEMO O=C(NC[C@H]1CC[N@H+](C2CC2)C1)c1c(F)c(F)c(Br)c(F)c1F ZINC000666916423 567712421 /nfs/dbraw/zinc/71/24/21/567712421.db2.gz TUDNXMNHONRSMJ-SSDOTTSWSA-N 1 1 395.194 3.220 10 0 GGAEMO O=C(c1[nH]nc2ccc(Br)cc21)N1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000646382764 567713417 /nfs/dbraw/zinc/71/34/17/567713417.db2.gz VGKVOIHWYCDEEZ-OLZOCXBDSA-N 1 1 391.313 3.177 10 0 GGAEMO Cc1ccc(I)c(C(=O)N2CCC[C@@]3(CC[N@H+](C)C3)C2)c1 ZINC000597716143 567713877 /nfs/dbraw/zinc/71/38/77/567713877.db2.gz OHCHDDNWRQLOMY-KRWDZBQOSA-N 1 1 398.288 3.158 10 0 GGAEMO C[N@@H+](Cc1cccc(Br)c1OC[C@@H]1CCCO1)CC1(O)CCC1 ZINC000442890062 567716069 /nfs/dbraw/zinc/71/60/69/567716069.db2.gz GVGGKIIZEYAVCO-HNNXBMFYSA-N 1 1 384.314 3.354 10 0 GGAEMO CCCN(C(=O)Nc1cnc2c(Br)cccn12)[C@@H]1CC[N@@H+](C)C1 ZINC000646403166 567716294 /nfs/dbraw/zinc/71/62/94/567716294.db2.gz ZSXZTBXMYJMCQA-GFCCVEGCSA-N 1 1 380.290 3.045 10 0 GGAEMO COc1ccc(-c2nc(CSC[C@@H]3C[N@H+](C)CCO3)cs2)c(OC)c1 ZINC000573487307 567716705 /nfs/dbraw/zinc/71/67/05/567716705.db2.gz DWRXOOLDLCBRIH-HNNXBMFYSA-N 1 1 380.535 3.391 10 0 GGAEMO COc1ccc(-c2nc(CSC[C@@H]3C[N@@H+](C)CCO3)cs2)c(OC)c1 ZINC000573487307 567716709 /nfs/dbraw/zinc/71/67/09/567716709.db2.gz DWRXOOLDLCBRIH-HNNXBMFYSA-N 1 1 380.535 3.391 10 0 GGAEMO C[N@H+]1CC[C@@H](N[C@@H]2CCN(c3cccc(Br)c3)C2=O)CC1(C)C ZINC000623508804 567717277 /nfs/dbraw/zinc/71/72/77/567717277.db2.gz JGULOSDAGMRZDS-GDBMZVCRSA-N 1 1 380.330 3.017 10 0 GGAEMO C[C@@H]([NH2+]Cc1cn2cc(Cl)ccc2n1)c1cccc(NS(C)(=O)=O)c1 ZINC000532459834 567717560 /nfs/dbraw/zinc/71/75/60/567717560.db2.gz RADQUNOCKWXXGI-GFCCVEGCSA-N 1 1 378.885 3.210 10 0 GGAEMO C[N@H+]1CCC[C@@H]1[C@@H]1COCCN1C(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1 ZINC000646450851 567718231 /nfs/dbraw/zinc/71/82/31/567718231.db2.gz ZJOGJNFTGVAETA-FJIDUMEYSA-N 1 1 383.319 3.419 10 0 GGAEMO C[C@H](Oc1cccc(Cl)c1Cl)C(=O)N1CCOC[C@@H]1[C@H]1CCC[N@H+]1C ZINC000646447500 567718489 /nfs/dbraw/zinc/71/84/89/567718489.db2.gz UNISWQOALOZPGB-NWANDNLSSA-N 1 1 387.307 3.082 10 0 GGAEMO C[N@H+]1CCC[C@@H]1[C@H]1COCCN1C(=O)c1cc(Br)ccc1Cl ZINC000646449519 567718538 /nfs/dbraw/zinc/71/85/38/567718538.db2.gz OGOOMVWUCRONRR-HUUCEWRRSA-N 1 1 387.705 3.038 10 0 GGAEMO C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCOC[C@H]1[C@H]1CCC[N@H+]1C ZINC000646449960 567718661 /nfs/dbraw/zinc/71/86/61/567718661.db2.gz SDYUIESRPKTTMM-VUCTXSBTSA-N 1 1 387.307 3.082 10 0 GGAEMO C[N@H+]1CCC[C@H]1[C@H]1COCCN1C(=O)c1csc(-c2ccc(Cl)s2)n1 ZINC000646443610 567718802 /nfs/dbraw/zinc/71/88/02/567718802.db2.gz HFBOEOVDMMNCLB-QWHCGFSZSA-N 1 1 397.953 3.460 10 0 GGAEMO C[N@H+]1CCC[C@@H]1[C@@H]1COCCN1C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000646450854 567718837 /nfs/dbraw/zinc/71/88/37/567718837.db2.gz ZJOGJNFTGVAETA-XDNAFOTISA-N 1 1 383.319 3.419 10 0 GGAEMO C[N@H+]1CCC[C@@H]1[C@@H]1COCCN1C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1 ZINC000646450853 567719056 /nfs/dbraw/zinc/71/90/56/567719056.db2.gz ZJOGJNFTGVAETA-TVFCKZIOSA-N 1 1 383.319 3.419 10 0 GGAEMO C[N@H+]1CCC[C@@H]1[C@H]1COCCN1C(=O)c1ccc(C(F)(F)F)cc1Cl ZINC000646445684 567719120 /nfs/dbraw/zinc/71/91/20/567719120.db2.gz CCLRSQCPUNGPKH-HUUCEWRRSA-N 1 1 376.806 3.294 10 0 GGAEMO Cc1ccc(I)c(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)c1 ZINC000597859047 567719191 /nfs/dbraw/zinc/71/91/91/567719191.db2.gz QPSCISYSWCMILS-LBPRGKRZSA-N 1 1 386.277 3.202 10 0 GGAEMO C[N@H+]1CCC[C@H]1[C@H]1COCCN1C(=O)c1ccc(C(F)(F)F)cc1Cl ZINC000646445685 567719132 /nfs/dbraw/zinc/71/91/32/567719132.db2.gz CCLRSQCPUNGPKH-LSDHHAIUSA-N 1 1 376.806 3.294 10 0 GGAEMO 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395.341 3.399 10 0 GGAEMO OC[C@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1Nc1ncc(Br)cc1F ZINC000623989075 567752174 /nfs/dbraw/zinc/75/21/74/567752174.db2.gz IUFQRZVLYLQGDJ-PBHICJAKSA-N 1 1 394.288 3.278 10 0 GGAEMO Cc1ncsc1-c1ccc(C[N@H+]2CCCC[C@H]2CNS(C)(=O)=O)cc1 ZINC000667503975 567752982 /nfs/dbraw/zinc/75/29/82/567752982.db2.gz CRXHKHSEIQZWDN-KRWDZBQOSA-N 1 1 379.551 3.022 10 0 GGAEMO C[C@@H](Cc1ccc(Br)cc1)NC(=O)c1cc(C[NH+]2CCCC2)on1 ZINC000461907884 567753149 /nfs/dbraw/zinc/75/31/49/567753149.db2.gz OBPOJQBWBSYOBA-ZDUSSCGKSA-N 1 1 392.297 3.394 10 0 GGAEMO C[N@H+]1CCCC[C@H](CNC(=O)N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000624002789 567753794 /nfs/dbraw/zinc/75/37/94/567753794.db2.gz FNWGFJPSFZHVLG-CZUORRHYSA-N 1 1 396.329 3.304 10 0 GGAEMO CCOc1c(Br)cc(Br)cc1C[N@@H+](C)[C@@H](C)CO ZINC000554884478 567754183 /nfs/dbraw/zinc/75/41/83/567754183.db2.gz SCALXKIHAAWVMY-VIFPVBQESA-N 1 1 381.108 3.423 10 0 GGAEMO COc1ccc([C@@H]([NH2+][C@H](CO)c2ccnn2C)C(C)C)c(Br)c1 ZINC000624021916 567755025 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O=C1Nc2ccccc2[C@@]12CC[N@@H+](Cc1c(F)cncc1Br)C2 ZINC000668010846 567789012 /nfs/dbraw/zinc/78/90/12/567789012.db2.gz KTTLCGVGPGFGSF-KRWDZBQOSA-N 1 1 376.229 3.079 10 0 GGAEMO O=C1Nc2ccccc2[C@@]12CC[N@H+](Cc1c(F)cncc1Br)C2 ZINC000668010846 567789015 /nfs/dbraw/zinc/78/90/15/567789015.db2.gz KTTLCGVGPGFGSF-KRWDZBQOSA-N 1 1 376.229 3.079 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)N[C@H]1C[N@H+](C)Cc2ccccc21 ZINC000533831637 567789843 /nfs/dbraw/zinc/78/98/43/567789843.db2.gz IYNMITYNTRLQLF-KRWDZBQOSA-N 1 1 389.293 3.303 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)N[C@H]1C[N@@H+](C)Cc2ccccc21 ZINC000533831637 567789847 /nfs/dbraw/zinc/78/98/47/567789847.db2.gz IYNMITYNTRLQLF-KRWDZBQOSA-N 1 1 389.293 3.303 10 0 GGAEMO C[C@@H]1C[NH+](C[C@H]2CCCN2C(=O)c2csc(C(F)(F)F)c2)C[C@@H](C)O1 ZINC000624610725 567790316 /nfs/dbraw/zinc/79/03/16/567790316.db2.gz ZBOAVFPUUUOCAE-YRGRVCCFSA-N 1 1 376.444 3.481 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2F)[C@@H](C)C1 ZINC000444083168 567790845 /nfs/dbraw/zinc/79/08/45/567790845.db2.gz JOKCQHAOPXTNEF-FZMZJTMJSA-N 1 1 382.423 3.195 10 0 GGAEMO Cc1c(C(=O)N2[C@H](C)C[NH+](C)C[C@H]2C)cnn1-c1ccc(Br)cc1 ZINC000555604389 567790853 /nfs/dbraw/zinc/79/08/53/567790853.db2.gz MFWNEZGAMXCAJZ-CHWSQXEVSA-N 1 1 391.313 3.108 10 0 GGAEMO CS(=O)(=O)N1CC[C@H](C[N@H+]2CCCCC[C@H]2Cc2ccccc2Cl)C1 ZINC000555613293 567790969 /nfs/dbraw/zinc/79/09/69/567790969.db2.gz UJJKDDOPQBHHCF-AEFFLSMTSA-N 1 1 384.973 3.409 10 0 GGAEMO Cc1c(C(=O)N2[C@@H](C)C[NH+](C)C[C@@H]2C)cnn1-c1ccc(Br)cc1 ZINC000555604390 567791227 /nfs/dbraw/zinc/79/12/27/567791227.db2.gz MFWNEZGAMXCAJZ-STQMWFEESA-N 1 1 391.313 3.108 10 0 GGAEMO CCSc1ccc(CC(=O)N[C@@H]2CC[N@H+](C3CC3)C2)c(Br)c1 ZINC000624611863 567791711 /nfs/dbraw/zinc/79/17/11/567791711.db2.gz DLJISJCXCDZWLS-CYBMUJFWSA-N 1 1 383.355 3.457 10 0 GGAEMO COCC[N@H+]1CCCN(C(=O)c2ccc(OC(F)(F)F)c(Cl)c2)CC1 ZINC000624619980 567791787 /nfs/dbraw/zinc/79/17/87/567791787.db2.gz RFEKPZPVTBEXHK-UHFFFAOYSA-N 1 1 380.794 3.033 10 0 GGAEMO C[C@@H]1C[N@H+](CCO)[C@H](C)CN1C(=O)c1cc(Br)c2ccccc2c1 ZINC000668040537 567792792 /nfs/dbraw/zinc/79/27/92/567792792.db2.gz CZHAJABXAAZULL-ZIAGYGMSSA-N 1 1 391.309 3.129 10 0 GGAEMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1C(=O)c1cc(Br)c2ccccc2c1 ZINC000668040537 567792794 /nfs/dbraw/zinc/79/27/94/567792794.db2.gz CZHAJABXAAZULL-ZIAGYGMSSA-N 1 1 391.309 3.129 10 0 GGAEMO O=C(c1cc(Cl)cc(F)c1Br)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000647631486 567793777 /nfs/dbraw/zinc/79/37/77/567793777.db2.gz IJCHKHMNQUMFKV-OLZOCXBDSA-N 1 1 393.659 3.500 10 0 GGAEMO O=C(CCCOc1ccccc1Br)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000647628340 567793959 /nfs/dbraw/zinc/79/39/59/567793959.db2.gz JOHOHLKDVQRNAY-HZPDHXFCSA-N 1 1 399.304 3.253 10 0 GGAEMO O=C(c1cc(Cl)ccc1Br)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000647628486 567794052 /nfs/dbraw/zinc/79/40/52/567794052.db2.gz LLQPMVYQPGIFHY-ZIAGYGMSSA-N 1 1 375.669 3.361 10 0 GGAEMO COc1ccc(CCC(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)cc1Br ZINC000647633600 567794774 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C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)C[C@@H]1CCCN(S(C)(=O)=O)C1 ZINC000444242726 567798853 /nfs/dbraw/zinc/79/88/53/567798853.db2.gz GRSAXMMYAXCBSE-KBPBESRZSA-N 1 1 378.460 3.370 10 0 GGAEMO C[C@@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)C[C@H]1CCCN(S(C)(=O)=O)C1 ZINC000444242729 567798875 /nfs/dbraw/zinc/79/88/75/567798875.db2.gz GRSAXMMYAXCBSE-UONOGXRCSA-N 1 1 378.460 3.370 10 0 GGAEMO CC[N@H+](Cc1ccc(Cl)c(Cl)c1)C[C@@H]1CCCN(S(C)(=O)=O)C1 ZINC000444254353 567799037 /nfs/dbraw/zinc/79/90/37/567799037.db2.gz WUXNQJVMJKCACL-AWEZNQCLSA-N 1 1 379.353 3.487 10 0 GGAEMO O=C(NC[C@H]1CC[N@H+]1C1CCCC1)N[C@@H](CO)c1cccc(Cl)c1Cl ZINC000624788565 567800305 /nfs/dbraw/zinc/80/03/05/567800305.db2.gz WAUZAWDHZLROAY-CJNGLKHVSA-N 1 1 386.323 3.343 10 0 GGAEMO CCC(F)(F)C(C)(C)CS(=O)(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000624795385 567801264 /nfs/dbraw/zinc/80/12/64/567801264.db2.gz FJNLHOIDGOMGLS-AWEZNQCLSA-N 1 1 378.485 3.407 10 0 GGAEMO CC(C)(C)OC(=O)c1ccc(C[NH2+]Cc2cccc(S(C)(=O)=O)c2)s1 ZINC000598980204 567801906 /nfs/dbraw/zinc/80/19/06/567801906.db2.gz KGFCQJMYNHHZMG-UHFFFAOYSA-N 1 1 381.519 3.397 10 0 GGAEMO CN1CC[C@@H]([NH2+]CCOc2ccc(I)cc2)CC1(C)C ZINC000598980830 567802268 /nfs/dbraw/zinc/80/22/68/567802268.db2.gz YFSRLRWFIXHXEI-CQSZACIVSA-N 1 1 388.293 3.132 10 0 GGAEMO C[N@@H+]1CC[C@@H](NCCOc2ccc(I)cc2)CC1(C)C ZINC000598980830 567802273 /nfs/dbraw/zinc/80/22/73/567802273.db2.gz YFSRLRWFIXHXEI-CQSZACIVSA-N 1 1 388.293 3.132 10 0 GGAEMO C[N@H+]1CC[C@@H](NCCOc2ccc(I)cc2)CC1(C)C ZINC000598980830 567802275 /nfs/dbraw/zinc/80/22/75/567802275.db2.gz YFSRLRWFIXHXEI-CQSZACIVSA-N 1 1 388.293 3.132 10 0 GGAEMO Fc1ccc(I)c(F)c1C[NH2+][C@H]1CO[C@@H](C2CC2)C1 ZINC000599009907 567802653 /nfs/dbraw/zinc/80/26/53/567802653.db2.gz ONFBOMLPBUPJIM-NOZJJQNGSA-N 1 1 379.188 3.227 10 0 GGAEMO COC(=O)c1cc(C[NH2+]Cc2cc(F)c(Br)cc2F)n(C)c1C ZINC000598999121 567802661 /nfs/dbraw/zinc/80/26/61/567802661.db2.gz FNSGNZDDMUMRPP-UHFFFAOYSA-N 1 1 387.224 3.451 10 0 GGAEMO C[N@H+]1CCC[C@@H]1[C@H]1COCCN1C(=O)c1[nH]c2ccc(Cl)cc2c1Cl ZINC000647822077 567802752 /nfs/dbraw/zinc/80/27/52/567802752.db2.gz PXKLLSMZDSMQPA-HUUCEWRRSA-N 1 1 382.291 3.410 10 0 GGAEMO Fc1ccc(I)c(F)c1C[NH2+][C@@H]1CO[C@H](C2CC2)C1 ZINC000599009910 567802869 /nfs/dbraw/zinc/80/28/69/567802869.db2.gz ONFBOMLPBUPJIM-ZANVPECISA-N 1 1 379.188 3.227 10 0 GGAEMO C[N@H+]1CCC[C@@H]1[C@@H]1COCCN1C(=O)Cc1csc2ccc(Cl)cc12 ZINC000647821778 567802851 /nfs/dbraw/zinc/80/28/51/567802851.db2.gz MBDINRWAENBGIO-SJORKVTESA-N 1 1 378.925 3.419 10 0 GGAEMO C[N@H+]1CCC[C@@H]1[C@H]1COCCN1C(=O)c1cccc(Br)c1Cl ZINC000647823040 567802889 /nfs/dbraw/zinc/80/28/89/567802889.db2.gz BUHQZRDQWMGGRJ-ZIAGYGMSSA-N 1 1 387.705 3.038 10 0 GGAEMO C[N@H+]1CCC[C@@H]1[C@@H]1COCCN1C(=O)c1cccc(Br)c1Cl ZINC000647823038 567803173 /nfs/dbraw/zinc/80/31/73/567803173.db2.gz BUHQZRDQWMGGRJ-KGLIPLIRSA-N 1 1 387.705 3.038 10 0 GGAEMO C[N@H+]1CCC[C@H]1[C@@H]1COCCN1C(=O)Cc1csc2ccc(Cl)cc12 ZINC000647821777 567803302 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Cn1cc([C@@H]([NH2+]Cc2cc(F)ccc2Br)C2(CO)CCC2)cn1 ZINC000647945394 567808012 /nfs/dbraw/zinc/80/80/12/567808012.db2.gz YWYLRSATAHPXLJ-MRXNPFEDSA-N 1 1 382.277 3.315 10 0 GGAEMO Brc1ccc(CN2CC[NH+](CCO[C@H]3CCCCO3)CC2)cc1 ZINC000444643480 567809461 /nfs/dbraw/zinc/80/94/61/567809461.db2.gz CDDHFFZOZWECFJ-SFHVURJKSA-N 1 1 383.330 3.110 10 0 GGAEMO CCOCC[C@@H](O)C[N@H+]1CCC[C@@H]1c1ccccc1I ZINC000444645872 567809769 /nfs/dbraw/zinc/80/97/69/567809769.db2.gz IHZNECXWKKOEGZ-CZUORRHYSA-N 1 1 389.277 3.216 10 0 GGAEMO FC(F)Oc1ccc(C[N@H+]2CC[C@@H](Cn3ccnn3)C2)cc1Br ZINC000668453328 567810055 /nfs/dbraw/zinc/81/00/55/567810055.db2.gz SIHLCJIUCKBIPF-GFCCVEGCSA-N 1 1 387.228 3.164 10 0 GGAEMO CN(CCOc1ccc(Cl)cc1)C(=O)C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000444695359 567810232 /nfs/dbraw/zinc/81/02/32/567810232.db2.gz MGMQWBPYEQSZMK-CYBMUJFWSA-N 1 1 378.822 3.452 10 0 GGAEMO Cc1cc(Br)ccc1C[N@H+](C)CC(=O)N1CCO[C@H]2CCCC[C@H]21 ZINC000444693942 567810315 /nfs/dbraw/zinc/81/03/15/567810315.db2.gz BGENAFQBVMNQEF-MSOLQXFVSA-N 1 1 395.341 3.359 10 0 GGAEMO Cc1cc(Br)ccc1C[N@@H+](C)CC(=O)N1CCO[C@H]2CCCC[C@H]21 ZINC000444693942 567810318 /nfs/dbraw/zinc/81/03/18/567810318.db2.gz BGENAFQBVMNQEF-MSOLQXFVSA-N 1 1 395.341 3.359 10 0 GGAEMO Cc1cc(Br)ccc1C[N@H+](C)CC(=O)N1CCO[C@@H]2CCCC[C@@H]21 ZINC000444693945 567810403 /nfs/dbraw/zinc/81/04/03/567810403.db2.gz BGENAFQBVMNQEF-ZWKOTPCHSA-N 1 1 395.341 3.359 10 0 GGAEMO Cc1cc(Br)ccc1C[N@@H+](C)CC(=O)N1CCO[C@@H]2CCCC[C@@H]21 ZINC000444693945 567810407 /nfs/dbraw/zinc/81/04/07/567810407.db2.gz BGENAFQBVMNQEF-ZWKOTPCHSA-N 1 1 395.341 3.359 10 0 GGAEMO C[C@]1(c2ccccc2)CC[C@@H]([N@H+]2C[C@H](C(F)(F)F)[C@@H](S(C)(=O)=O)C2)C1 ZINC000668469882 567810651 /nfs/dbraw/zinc/81/06/51/567810651.db2.gz MMTFVFYVRRZCNA-QZWWFDLISA-N 1 1 375.456 3.404 10 0 GGAEMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)c1cc(Br)cc(N2CCCC2)c1 ZINC000668457734 567810801 /nfs/dbraw/zinc/81/08/01/567810801.db2.gz ODACURWDWRUMJN-QGZVFWFLSA-N 1 1 392.341 3.263 10 0 GGAEMO C[N@H+]1CCC[C@@H](CNC(=O)c2c(F)c(F)c(Br)c(F)c2F)C1 ZINC000668463512 567810841 /nfs/dbraw/zinc/81/08/41/567810841.db2.gz SBSASVVCQAHHLA-ZETCQYMHSA-N 1 1 383.183 3.077 10 0 GGAEMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1c(F)c(F)c(Br)c(F)c1F ZINC000668457823 567810918 /nfs/dbraw/zinc/81/09/18/567810918.db2.gz PZOCHQYTLIIJAV-QMMMGPOBSA-N 1 1 395.194 3.220 10 0 GGAEMO C[N@H+]1CCC[C@H](CNC(=O)c2c(F)c(F)c(Br)c(F)c2F)C1 ZINC000668463511 567811163 /nfs/dbraw/zinc/81/11/63/567811163.db2.gz SBSASVVCQAHHLA-SSDOTTSWSA-N 1 1 383.183 3.077 10 0 GGAEMO CC1(C)C[N@@H+](C[C@H](O)COc2c(Cl)cccc2Cl)C[C@]2(CCOC2)O1 ZINC000575060241 567811425 /nfs/dbraw/zinc/81/14/25/567811425.db2.gz WTSSUXVLNUFOBC-UGSOOPFHSA-N 1 1 390.307 3.003 10 0 GGAEMO CC1(C)C[N@@H+](C[C@@H](O)COc2c(Cl)cccc2Cl)C[C@@]2(CCOC2)O1 ZINC000575060239 567811442 /nfs/dbraw/zinc/81/14/42/567811442.db2.gz WTSSUXVLNUFOBC-FZKQIMNGSA-N 1 1 390.307 3.003 10 0 GGAEMO Cc1nn(-c2ccc(Br)cc2)c(C)c1C[NH2+]CCCN1CCC1 ZINC000575072061 567811541 /nfs/dbraw/zinc/81/15/41/567811541.db2.gz PFTUBXQSDMUORL-UHFFFAOYSA-N 1 1 377.330 3.437 10 0 GGAEMO COC(=O)c1cnc(C[N@H+](Cc2cccc(Br)c2)C2CC2)cn1 ZINC000599258958 567811931 /nfs/dbraw/zinc/81/19/31/567811931.db2.gz IHYRMSIYQNVURD-UHFFFAOYSA-N 1 1 376.254 3.190 10 0 GGAEMO COC(=O)c1cnc(C[N@@H+](Cc2cccc(Br)c2)C2CC2)cn1 ZINC000599258958 567811934 /nfs/dbraw/zinc/81/19/34/567811934.db2.gz IHYRMSIYQNVURD-UHFFFAOYSA-N 1 1 376.254 3.190 10 0 GGAEMO NC(=O)c1ccc(NC(=O)CC[N@H+]2CC[C@H](CC(F)(F)F)C2)cc1Cl ZINC000444711537 567811882 /nfs/dbraw/zinc/81/18/82/567811882.db2.gz XSQRMNDMLDCFKF-SNVBAGLBSA-N 1 1 377.794 3.042 10 0 GGAEMO C[C@H](NC(=O)C[N@@H+]1CCC[C@H]([C@@H](O)C(F)(F)F)C1)c1ccc(Cl)cc1 ZINC000444727444 567812225 /nfs/dbraw/zinc/81/22/25/567812225.db2.gz JXJXRKBMLDYMDY-DETPVDSQSA-N 1 1 378.822 3.152 10 0 GGAEMO C[C@H](NC(=O)C[N@H+]1CCC[C@H]([C@@H](O)C(F)(F)F)C1)c1ccc(Cl)cc1 ZINC000444727444 567812230 /nfs/dbraw/zinc/81/22/30/567812230.db2.gz JXJXRKBMLDYMDY-DETPVDSQSA-N 1 1 378.822 3.152 10 0 GGAEMO CO[C@@]1(CO)CCC[N@H+](Cc2ccc(OC(F)(F)F)c(Br)c2)C1 ZINC000668499072 567812537 /nfs/dbraw/zinc/81/25/37/567812537.db2.gz SMAADOVMDBLHPK-AWEZNQCLSA-N 1 1 398.219 3.321 10 0 GGAEMO CO[C@@]1(CO)CCC[N@@H+](Cc2ccc(OC(F)(F)F)c(Br)c2)C1 ZINC000668499072 567812538 /nfs/dbraw/zinc/81/25/38/567812538.db2.gz SMAADOVMDBLHPK-AWEZNQCLSA-N 1 1 398.219 3.321 10 0 GGAEMO C[C@H]1OCC[C@H]1[N@H+](CCO)Cc1cc(OC(F)F)ccc1Br ZINC000648041621 567812562 /nfs/dbraw/zinc/81/25/62/567812562.db2.gz ZDRGDKJAAOWATE-QMTHXVAHSA-N 1 1 380.229 3.022 10 0 GGAEMO C[C@H]1OCC[C@H]1[N@@H+](CCO)Cc1cc(OC(F)F)ccc1Br ZINC000648041621 567812563 /nfs/dbraw/zinc/81/25/63/567812563.db2.gz ZDRGDKJAAOWATE-QMTHXVAHSA-N 1 1 380.229 3.022 10 0 GGAEMO CO[C@@]1(CO)CCC[N@H+](Cc2ccc(OC(F)F)c(Br)c2)C1 ZINC000668499316 567812773 /nfs/dbraw/zinc/81/27/73/567812773.db2.gz VRLRWUUDIXDYNI-HNNXBMFYSA-N 1 1 380.229 3.024 10 0 GGAEMO CO[C@@]1(CO)CCC[N@@H+](Cc2ccc(OC(F)F)c(Br)c2)C1 ZINC000668499316 567812776 /nfs/dbraw/zinc/81/27/76/567812776.db2.gz VRLRWUUDIXDYNI-HNNXBMFYSA-N 1 1 380.229 3.024 10 0 GGAEMO CO[C@]1(CO)CCC[N@H+](Cc2ccc(OC(F)(F)F)c(Br)c2)C1 ZINC000668499073 567812820 /nfs/dbraw/zinc/81/28/20/567812820.db2.gz SMAADOVMDBLHPK-CQSZACIVSA-N 1 1 398.219 3.321 10 0 GGAEMO CO[C@]1(CO)CCC[N@@H+](Cc2ccc(OC(F)(F)F)c(Br)c2)C1 ZINC000668499073 567812823 /nfs/dbraw/zinc/81/28/23/567812823.db2.gz SMAADOVMDBLHPK-CQSZACIVSA-N 1 1 398.219 3.321 10 0 GGAEMO C[N@H+](Cc1cnc(-c2ccc(Br)cc2)s1)C[C@@H]1COCCO1 ZINC000668544817 567813063 /nfs/dbraw/zinc/81/30/63/567813063.db2.gz HWNMMTKCZGRQBA-CQSZACIVSA-N 1 1 383.311 3.420 10 0 GGAEMO Cc1nn(-c2ccc(Br)cc2)cc1C[N@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1 ZINC000668553851 567813536 /nfs/dbraw/zinc/81/35/36/567813536.db2.gz HVLSHAVYSWQSEH-MCBXIFIFSA-N 1 1 378.314 3.392 10 0 GGAEMO CCOCCOc1ccc(Br)cc1C[N@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1 ZINC000668554147 567813936 /nfs/dbraw/zinc/81/39/36/567813936.db2.gz KMCJMRAXYWRVAN-UOIKSKOESA-N 1 1 386.330 3.313 10 0 GGAEMO CCOCCOc1ccc(Br)cc1C[N@@H+]1C[C@@H](C)[C@H](O)[C@@H](C)C1 ZINC000668554147 567813938 /nfs/dbraw/zinc/81/39/38/567813938.db2.gz KMCJMRAXYWRVAN-UOIKSKOESA-N 1 1 386.330 3.313 10 0 GGAEMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1ccc(Cl)c(N)c1Cl ZINC000648130299 567814118 /nfs/dbraw/zinc/81/41/18/567814118.db2.gz XKCPCZFGOFHZKO-CQSZACIVSA-N 1 1 380.275 3.371 10 0 GGAEMO Cc1nn(-c2cccc(Br)c2)cc1C[N@H+]1C[C@@H]2COC[C@]2(C)C1 ZINC000668596269 567814394 /nfs/dbraw/zinc/81/43/94/567814394.db2.gz FMJMYYAEQKVNQW-QAPCUYQASA-N 1 1 376.298 3.412 10 0 GGAEMO Cc1nn(-c2ccc(Br)cc2)cc1C[N@H+]1C[C@H]2COC[C@]2(C)C1 ZINC000668598577 567814614 /nfs/dbraw/zinc/81/46/14/567814614.db2.gz ZGZYDRNSIHRQJQ-YJBOKZPZSA-N 1 1 376.298 3.412 10 0 GGAEMO Cc1nn(-c2ccc(Br)cc2)cc1C[N@H+]1C[C@@H]2COC[C@@]2(C)C1 ZINC000668598574 567814814 /nfs/dbraw/zinc/81/48/14/567814814.db2.gz ZGZYDRNSIHRQJQ-CRAIPNDOSA-N 1 1 376.298 3.412 10 0 GGAEMO CCCC[N@@H+](C)CCNC(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000668638134 567815268 /nfs/dbraw/zinc/81/52/68/567815268.db2.gz BSMWHTNFTBQERI-UHFFFAOYSA-N 1 1 385.199 3.467 10 0 GGAEMO COc1ccc(S(=O)(=O)N[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)cc1Cl ZINC000534637210 567815538 /nfs/dbraw/zinc/81/55/38/567815538.db2.gz CHMINNIHSJAVEA-AEFFLSMTSA-N 1 1 380.897 3.072 10 0 GGAEMO COc1ccc(S(=O)(=O)N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cc1Cl ZINC000534637210 567815540 /nfs/dbraw/zinc/81/55/40/567815540.db2.gz CHMINNIHSJAVEA-AEFFLSMTSA-N 1 1 380.897 3.072 10 0 GGAEMO COc1ccc(-c2nc3c([nH]2)C[N@@H+](CCC(=O)N2CCC(C)CC2)CC3)cc1 ZINC000096149831 570215017 /nfs/dbraw/zinc/21/50/17/570215017.db2.gz PGMXFCIIMCFORB-UHFFFAOYSA-N 1 1 382.508 3.092 10 0 GGAEMO CC[NH+]1CCN(C(=O)C[C@@H](c2ccc(F)cc2)N2Cc3ccccc3C2=O)CC1 ZINC000015721100 570218328 /nfs/dbraw/zinc/21/83/28/570218328.db2.gz IFLAPGVSJNFZJL-NRFANRHFSA-N 1 1 395.478 3.077 10 0 GGAEMO C[C@@H](C(=O)N(C)CC(=O)Nc1ccccc1C(F)(F)F)[N@H+]1CCC[C@@H](C)C1 ZINC000012809835 570221826 /nfs/dbraw/zinc/22/18/26/570221826.db2.gz PCJRGBRXXORJRI-KGLIPLIRSA-N 1 1 385.430 3.223 10 0 GGAEMO Cc1ccc(NC(=O)[C@@H](C)[NH+]2CCC(C(=O)NCc3ccccc3)CC2)cc1F ZINC000012808154 570222244 /nfs/dbraw/zinc/22/22/44/570222244.db2.gz RLCFGWMKARQCDS-QGZVFWFLSA-N 1 1 397.494 3.490 10 0 GGAEMO CSc1cccc(NC(=O)C[NH+]2CCC(C(=O)NCc3ccccc3)CC2)c1 ZINC000012808922 570222342 /nfs/dbraw/zinc/22/23/42/570222342.db2.gz CXGFDEUVKNPPOI-UHFFFAOYSA-N 1 1 397.544 3.375 10 0 GGAEMO Fc1ccc(-n2ncc3c2ncnc3N2CC[NH+](Cc3ccsc3)CC2)cc1 ZINC000012813732 570228223 /nfs/dbraw/zinc/22/82/23/570228223.db2.gz NBNQPONEIJODLX-UHFFFAOYSA-N 1 1 394.479 3.338 10 0 GGAEMO COCC[N@H+]1CCCN(C(=O)[C@H](C)Oc2ccc(-c3ccccc3)cc2)CC1 ZINC000048429026 570250886 /nfs/dbraw/zinc/25/08/86/570250886.db2.gz WWRDLHALSAWBTH-IBGZPJMESA-N 1 1 382.504 3.302 10 0 GGAEMO CCc1nc2cccnc2n1-c1ccc(C(=O)NC[C@H]2CCC[N@@H+]2CC)cc1 ZINC000020934115 570250906 /nfs/dbraw/zinc/25/09/06/570250906.db2.gz MMCRPDQBJXEBLH-GOSISDBHSA-N 1 1 377.492 3.197 10 0 GGAEMO Fc1cccc(-c2n[nH]c3c2C[N@H+](Cc2ccc(-n4cncn4)cc2)CC3)c1F ZINC000020514491 570265052 /nfs/dbraw/zinc/26/50/52/570265052.db2.gz WDOVFVVGQLOLOL-UHFFFAOYSA-N 1 1 392.413 3.494 10 0 GGAEMO Fc1cccc(-c2n[nH]c3c2C[N@@H+](Cc2ccc(-n4cncn4)cc2)CC3)c1F ZINC000020514491 570265054 /nfs/dbraw/zinc/26/50/54/570265054.db2.gz WDOVFVVGQLOLOL-UHFFFAOYSA-N 1 1 392.413 3.494 10 0 GGAEMO CN(C)c1ccc(C(=O)N2CCC[N@H+](Cc3noc4ccccc43)CC2)cc1 ZINC000015828274 570268278 /nfs/dbraw/zinc/26/82/78/570268278.db2.gz GBYXHSVXDHXZPT-UHFFFAOYSA-N 1 1 378.476 3.242 10 0 GGAEMO CN(C)c1ccc(C(=O)N2CCC[N@@H+](Cc3noc4ccccc43)CC2)cc1 ZINC000015828274 570268281 /nfs/dbraw/zinc/26/82/81/570268281.db2.gz GBYXHSVXDHXZPT-UHFFFAOYSA-N 1 1 378.476 3.242 10 0 GGAEMO Cc1nn(-c2cccc(Cl)c2)nc1C(=O)NCCC[N@@H+]1CCC[C@@H](C)C1 ZINC000097327400 570271960 /nfs/dbraw/zinc/27/19/60/570271960.db2.gz AEYNXTRUAWJLJJ-CQSZACIVSA-N 1 1 375.904 3.081 10 0 GGAEMO O=C(NCc1ccc(C[NH+]2CCOCC2)cc1)c1ccc(OC(F)F)cc1 ZINC000012877562 570275514 /nfs/dbraw/zinc/27/55/14/570275514.db2.gz DPGRAZLDFYQHJE-UHFFFAOYSA-N 1 1 376.403 3.050 10 0 GGAEMO Cc1ccc2c(c1)nc(-c1cnn(C)c1)cc2C(=O)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000020863335 570282594 /nfs/dbraw/zinc/28/25/94/570282594.db2.gz GOWKTUYDDZUYFG-GOSISDBHSA-N 1 1 389.503 3.254 10 0 GGAEMO Cc1ccc2c(c1)nc(-c1cnn(C)c1)cc2C(=O)N1CC[N@H+]2CCCC[C@H]2C1 ZINC000020863340 570282712 /nfs/dbraw/zinc/28/27/12/570282712.db2.gz GOWKTUYDDZUYFG-SFHVURJKSA-N 1 1 389.503 3.254 10 0 GGAEMO CN(C(=O)c1cc(C(F)(F)F)n[nH]1)[C@H]1CCC[N@@H+](CCc2ccccc2)C1 ZINC000020996593 570286690 /nfs/dbraw/zinc/28/66/90/570286690.db2.gz FGMNJDCNKBNTDQ-HNNXBMFYSA-N 1 1 380.414 3.208 10 0 GGAEMO CN(C(=O)c1cc(C(F)(F)F)[nH]n1)[C@H]1CCC[N@H+](CCc2ccccc2)C1 ZINC000020996593 570286691 /nfs/dbraw/zinc/28/66/91/570286691.db2.gz FGMNJDCNKBNTDQ-HNNXBMFYSA-N 1 1 380.414 3.208 10 0 GGAEMO CN(C(=O)c1cc(C(F)(F)F)[nH]n1)[C@H]1CCC[N@@H+](CCc2ccccc2)C1 ZINC000020996593 570286692 /nfs/dbraw/zinc/28/66/92/570286692.db2.gz FGMNJDCNKBNTDQ-HNNXBMFYSA-N 1 1 380.414 3.208 10 0 GGAEMO COc1cc(CCC2CC[NH+](CC(=O)NCC(F)(F)F)CC2)cc(OC)c1 ZINC000021395883 570290964 /nfs/dbraw/zinc/29/09/64/570290964.db2.gz ZMISTHYCGQBJPD-UHFFFAOYSA-N 1 1 388.430 3.027 10 0 GGAEMO CC[C@@H]1c2ccsc2CC[N@@H+]1C[C@@H](O)COCc1ccc2c(c1)OCO2 ZINC000012920392 570294157 /nfs/dbraw/zinc/29/41/57/570294157.db2.gz OZQYJNMRXUTVLF-NVXWUHKLSA-N 1 1 375.490 3.364 10 0 GGAEMO CC[C@H]1c2ccsc2CC[N@@H+]1C[C@@H](O)COCc1ccc2c(c1)OCO2 ZINC000012920387 570294197 /nfs/dbraw/zinc/29/41/97/570294197.db2.gz OZQYJNMRXUTVLF-WBVHZDCISA-N 1 1 375.490 3.364 10 0 GGAEMO CCN(C(=O)C[NH+]1CCC(C(=O)Nc2ccccc2O)CC1)c1ccccc1C ZINC000012925159 570296088 /nfs/dbraw/zinc/29/60/88/570296088.db2.gz CZZKSCHIDVPKBJ-UHFFFAOYSA-N 1 1 395.503 3.404 10 0 GGAEMO Cc1cccc(C[NH+]2CCN(C(=O)CCNC(=O)c3ccc(Cl)cc3)CC2)c1 ZINC000021926367 570299563 /nfs/dbraw/zinc/29/95/63/570299563.db2.gz HNFUDOJFJFSAIJ-UHFFFAOYSA-N 1 1 399.922 3.113 10 0 GGAEMO C[C@H](Cc1ccc2c(c1)OCO2)C[N@H+]1CCc2nc(-c3cccnc3)[nH]c2C1 ZINC000216368278 570300183 /nfs/dbraw/zinc/30/01/83/570300183.db2.gz MOIXHQRHEVNGOU-OAHLLOKOSA-N 1 1 376.460 3.437 10 0 GGAEMO O=C(c1ccc(C[NH+]2CCN(c3ccccc3Cl)CC2)cc1)N1CCOCC1 ZINC000034684426 570301426 /nfs/dbraw/zinc/30/14/26/570301426.db2.gz NYSRKIHPIFGARG-UHFFFAOYSA-N 1 1 399.922 3.135 10 0 GGAEMO COc1ccc(NC(=O)[C@@H]2C[C@@H]3CCC[N@@H+]3[C@@]23C(=O)Nc2ccc(F)cc23)cc1 ZINC000015972141 570304108 /nfs/dbraw/zinc/30/41/08/570304108.db2.gz LGFBZUVVFFGNGT-LZFQIVBZSA-N 1 1 395.434 3.105 10 0 GGAEMO COc1ccc(NC(=O)[C@@H]2C[C@@H]3CCC[N@H+]3[C@@]23C(=O)Nc2ccc(F)cc23)cc1 ZINC000015972141 570304111 /nfs/dbraw/zinc/30/41/11/570304111.db2.gz LGFBZUVVFFGNGT-LZFQIVBZSA-N 1 1 395.434 3.105 10 0 GGAEMO CCc1ccc(CN(C)C(=O)NCc2ccc(C[NH+]3CCOCC3)cc2)cc1 ZINC000022436755 570317212 /nfs/dbraw/zinc/31/72/12/570317212.db2.gz NFDQKWLLBFNYCV-UHFFFAOYSA-N 1 1 381.520 3.423 10 0 GGAEMO CC(C)OCCOCc1cccc(NC(=O)N(C)[C@H]2CC[N@@H+](C)C[C@@H]2C)c1 ZINC000075110219 570318924 /nfs/dbraw/zinc/31/89/24/570318924.db2.gz OKZKMDVBTRPHKS-PXNSSMCTSA-N 1 1 377.529 3.432 10 0 GGAEMO 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BAUYAWPUDYZHDL-DSLXNQLJSA-N 1 1 397.485 3.476 10 0 GGAEMO C[C@@H]([NH2+][C@@H]1CCCC[C@@H]1C(F)(F)F)C(=O)N[C@H]1CCN(Cc2ccccc2)C1 ZINC000124793744 1415045602 /nfs/dbraw/zinc/04/56/02/1415045602.db2.gz BAUYAWPUDYZHDL-XGXHKWSGSA-N 1 1 397.485 3.476 10 0 GGAEMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)NCCCc1nc2ccccc2[nH]1 ZINC000125034246 1415096177 /nfs/dbraw/zinc/09/61/77/1415096177.db2.gz GPDYGLAMLXAOIU-SFHVURJKSA-N 1 1 391.519 3.411 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)NCCCc1nc2ccccc2[nH]1 ZINC000125034246 1415096182 /nfs/dbraw/zinc/09/61/82/1415096182.db2.gz GPDYGLAMLXAOIU-SFHVURJKSA-N 1 1 391.519 3.411 10 0 GGAEMO COC(=O)Nc1ccc(CNC(=O)N2CC[C@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc1 ZINC000125049515 1415099796 /nfs/dbraw/zinc/09/97/96/1415099796.db2.gz GOIQHEZZGASIIB-LPHOPBHVSA-N 1 1 386.496 3.023 10 0 GGAEMO COC(=O)c1ccc(C[N@H+](C)[C@H](C)C(=O)N[C@H](C)c2ccccc2OC)cc1 ZINC000125196546 1415128143 /nfs/dbraw/zinc/12/81/43/1415128143.db2.gz CGAPKZJPAMPSQJ-HZPDHXFCSA-N 1 1 384.476 3.180 10 0 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1415212416 /nfs/dbraw/zinc/21/24/16/1415212416.db2.gz HRMLINYFJBQBIN-MRXNPFEDSA-N 1 1 387.524 3.187 10 0 GGAEMO C[N@@H+](CC(=O)NCc1cccc(COCc2ccco2)c1)C[C@@H]1CCCCO1 ZINC000125979060 1415327818 /nfs/dbraw/zinc/32/78/18/1415327818.db2.gz HPPCYENNFOSXRV-FQEVSTJZSA-N 1 1 386.492 3.114 10 0 GGAEMO C[N@H+](CC(=O)NCc1cccc(COCc2ccco2)c1)C[C@@H]1CCCCO1 ZINC000125979060 1415327829 /nfs/dbraw/zinc/32/78/29/1415327829.db2.gz HPPCYENNFOSXRV-FQEVSTJZSA-N 1 1 386.492 3.114 10 0 GGAEMO C[N@@H+](CC(=O)NCc1cccc(COCc2ccco2)c1)C[C@H]1CCCCO1 ZINC000125979374 1415329088 /nfs/dbraw/zinc/32/90/88/1415329088.db2.gz HPPCYENNFOSXRV-HXUWFJFHSA-N 1 1 386.492 3.114 10 0 GGAEMO C[N@H+](CC(=O)NCc1cccc(COCc2ccco2)c1)C[C@H]1CCCCO1 ZINC000125979374 1415329099 /nfs/dbraw/zinc/32/90/99/1415329099.db2.gz HPPCYENNFOSXRV-HXUWFJFHSA-N 1 1 386.492 3.114 10 0 GGAEMO CCCCn1nc(C)c(CNC2CC[NH+](C3CCN(C)CC3)CC2)c1Cl ZINC000126039304 1415341873 /nfs/dbraw/zinc/34/18/73/1415341873.db2.gz BZSYPWKJZZLRGA-UHFFFAOYSA-N 1 1 381.996 3.293 10 0 GGAEMO Oc1ccc(Br)c(C[NH2+]C[C@@H]2CN(Cc3ccccc3)CCO2)c1 ZINC000126258115 1415396276 /nfs/dbraw/zinc/39/62/76/1415396276.db2.gz DJMDVSNBPLUNCD-GOSISDBHSA-N 1 1 391.309 3.145 10 0 GGAEMO COc1cccc([C@@H](C)[NH+]2CCN(Cc3nc4oc(C)c(C)c4c(N)n3)CC2)c1 ZINC000178014282 1428935134 /nfs/dbraw/zinc/93/51/34/1428935134.db2.gz DUEVSIWJHZRTKS-OAHLLOKOSA-N 1 1 395.507 3.309 10 0 GGAEMO COc1ccc(Br)c(C[NH2+]CC(=O)N(C)Cc2ccccc2)c1 ZINC000126911860 1415605279 /nfs/dbraw/zinc/60/52/79/1415605279.db2.gz BJUTZTFYBHISLF-UHFFFAOYSA-N 1 1 377.282 3.206 10 0 GGAEMO CC(=O)Oc1ccc(C[NH+]2CCN(c3ccc(C(F)(F)F)cn3)CC2)cc1 ZINC000178133967 1428994596 /nfs/dbraw/zinc/99/45/96/1428994596.db2.gz QHKZMENQQKMGPE-UHFFFAOYSA-N 1 1 379.382 3.348 10 0 GGAEMO COc1cc(CNc2ccc(C[N@H+]3CCC[C@H](C(N)=O)C3)cc2)cc(OC)c1 ZINC000127489715 1415799703 /nfs/dbraw/zinc/79/97/03/1415799703.db2.gz AHFJOUFFNKESIB-SFHVURJKSA-N 1 1 383.492 3.013 10 0 GGAEMO NC(=O)[C@H]1CCC[N@@H+](Cc2ccc(NCc3c[nH]nc3-c3ccccc3)cc2)C1 ZINC000127546451 1415807628 /nfs/dbraw/zinc/80/76/28/1415807628.db2.gz CMVQRXCGKKNQHT-IBGZPJMESA-N 1 1 389.503 3.386 10 0 GGAEMO NC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(NCc3c[nH]nc3-c3ccccc3)cc2)C1 ZINC000127546701 1415807754 /nfs/dbraw/zinc/80/77/54/1415807754.db2.gz CMVQRXCGKKNQHT-LJQANCHMSA-N 1 1 389.503 3.386 10 0 GGAEMO Cc1cc(N2CCC(NC(=O)[C@@H]3C[C@H]3c3c(F)cccc3F)CC2)nc(C)[nH+]1 ZINC000178180040 1429009956 /nfs/dbraw/zinc/00/99/56/1429009956.db2.gz HDBVDMSJOZWKKF-HZPDHXFCSA-N 1 1 386.446 3.260 10 0 GGAEMO COc1cc(C[NH+]2CCN(c3cccnn3)CC2)ccc1OCc1ccccc1 ZINC000127991505 1415889222 /nfs/dbraw/zinc/88/92/22/1415889222.db2.gz WSYSCZQQGTUPBD-UHFFFAOYSA-N 1 1 390.487 3.386 10 0 GGAEMO CCCOc1c(Cl)cc(C[NH2+]C[C@@H](C(C)C)N2CCN(C)CC2)cc1OC ZINC000128588583 1416020131 /nfs/dbraw/zinc/02/01/31/1416020131.db2.gz HRJGGYJNUGFEQL-IBGZPJMESA-N 1 1 397.991 3.499 10 0 GGAEMO CCCOc1cccc(CNc2ccc(CC(=O)N3CC[NH+](C)CC3)cc2)c1 ZINC000129133680 1416153301 /nfs/dbraw/zinc/15/33/01/1416153301.db2.gz FBIJVYANNLHSQC-UHFFFAOYSA-N 1 1 381.520 3.404 10 0 GGAEMO CCOc1ccc(C[NH2+][C@H](c2nc(-c3nc[nH]n3)no2)C(C)C)cc1OCC ZINC000129215746 1416172854 /nfs/dbraw/zinc/17/28/54/1416172854.db2.gz DJEWYUXXGYQORU-INIZCTEOSA-N 1 1 386.456 3.139 10 0 GGAEMO C[C@@H]1CC[N@@H+](CC(=O)NCc2ccc(F)cc2C(F)(F)F)C[C@@H]1n1ccnc1 ZINC000129442458 1416210161 /nfs/dbraw/zinc/21/01/61/1416210161.db2.gz BDOHURDCXPATKE-DYVFJYSZSA-N 1 1 398.404 3.240 10 0 GGAEMO C[C@@H]1CC[N@@H+](CC(=O)Nc2ccc(N3CCCCC3)cc2)C[C@@H]1n1ccnc1 ZINC000129559111 1416228347 /nfs/dbraw/zinc/22/83/47/1416228347.db2.gz HNTKVMPZFJGQKY-NQIIRXRSSA-N 1 1 381.524 3.395 10 0 GGAEMO C[C@@H](C(=O)N(C)Cc1nc2ccccc2s1)[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000129743187 1416256912 /nfs/dbraw/zinc/25/69/12/1416256912.db2.gz CTHLQZJYNFRUSE-RYRKJORJSA-N 1 1 397.548 3.423 10 0 GGAEMO C[C@@H](C(=O)N(C)Cc1nc2ccccc2s1)[N@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000129743187 1416256918 /nfs/dbraw/zinc/25/69/18/1416256918.db2.gz CTHLQZJYNFRUSE-RYRKJORJSA-N 1 1 397.548 3.423 10 0 GGAEMO Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)[N@@H+](C)CCCn1ccnc1C ZINC000130771693 1416447450 /nfs/dbraw/zinc/44/74/50/1416447450.db2.gz HJTNAZRFPAPZGO-SFHVURJKSA-N 1 1 394.523 3.343 10 0 GGAEMO CC(C)C[N@H+]1CCC[C@H](CNC(=O)N2CCC[C@H](NC(=O)OC(C)(C)C)C2)C1 ZINC000130843390 1416465450 /nfs/dbraw/zinc/46/54/50/1416465450.db2.gz BOWRJUVVJKFBRK-MSOLQXFVSA-N 1 1 396.576 3.053 10 0 GGAEMO COc1cc(OC)c(OC)cc1CNC1CC[NH+]([C@@H](C)c2ccncc2)CC1 ZINC000131077275 1416505324 /nfs/dbraw/zinc/50/53/24/1416505324.db2.gz BFFIAQYLWLAGID-INIZCTEOSA-N 1 1 385.508 3.423 10 0 GGAEMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)CCc1nc(-c2cccs2)no1 ZINC000135116419 1417173465 /nfs/dbraw/zinc/17/34/65/1417173465.db2.gz BSUMXYNLHKXHLL-INIZCTEOSA-N 1 1 396.516 3.464 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)CCc1nc(-c2cccs2)no1 ZINC000135116419 1417173469 /nfs/dbraw/zinc/17/34/69/1417173469.db2.gz BSUMXYNLHKXHLL-INIZCTEOSA-N 1 1 396.516 3.464 10 0 GGAEMO CC(C)Sc1ccccc1NC(=O)NCCC[N@H+]1CCC[C@@H]1C(=O)N(C)C ZINC000135375994 1417212656 /nfs/dbraw/zinc/21/26/56/1417212656.db2.gz FMLSNHRCYDOPOC-QGZVFWFLSA-N 1 1 392.569 3.251 10 0 GGAEMO CC(C)[C@@H](C[NH2+]Cc1cc(Br)ccc1Cl)N1CCN(C)CC1 ZINC000135859963 1417274049 /nfs/dbraw/zinc/27/40/49/1417274049.db2.gz HTPZXTCBXADWJY-QGZVFWFLSA-N 1 1 388.781 3.464 10 0 GGAEMO NC(=O)C1CCN(c2ncccc2C[NH2+]Cc2cnc(C3CCCC3)s2)CC1 ZINC000136043814 1417287391 /nfs/dbraw/zinc/28/73/91/1417287391.db2.gz HIFLOUKIVUSNBA-UHFFFAOYSA-N 1 1 399.564 3.187 10 0 GGAEMO COC(=O)c1ccc(C[NH+]2CCC(NC(=O)C3CCCCC3)CC2)c(F)c1 ZINC000136115548 1417292842 /nfs/dbraw/zinc/29/28/42/1417292842.db2.gz OQGXRYWMQJGQHU-UHFFFAOYSA-N 1 1 376.472 3.273 10 0 GGAEMO Cn1ccc(N2CCC[C@H]([NH2+]Cc3cc(Br)ccc3Cl)C2=O)n1 ZINC000136239637 1417303798 /nfs/dbraw/zinc/30/37/98/1417303798.db2.gz HSLYXGVADJEXBA-AWEZNQCLSA-N 1 1 397.704 3.121 10 0 GGAEMO Cn1ccc(N2CCC[C@@H]([NH2+]Cc3cc(Br)ccc3Cl)C2=O)n1 ZINC000136239674 1417304014 /nfs/dbraw/zinc/30/40/14/1417304014.db2.gz HSLYXGVADJEXBA-CQSZACIVSA-N 1 1 397.704 3.121 10 0 GGAEMO O[C@@H]1CCCC[C@@H]1[NH+]1CCC(NCc2ccc(Oc3cnccn3)cc2)CC1 ZINC000136599633 1417331325 /nfs/dbraw/zinc/33/13/25/1417331325.db2.gz BWGVTWKVEKZQBU-LEWJYISDSA-N 1 1 382.508 3.126 10 0 GGAEMO C[C@@H]1CCc2c(sc3nc(CCN4CC[C@@H]5[C@H](CCC[N@H+]5C)C4)nc(N)c23)C1 ZINC000140045409 1417486788 /nfs/dbraw/zinc/48/67/88/1417486788.db2.gz DKSYMJAITZOEGE-BFYDXBDKSA-N 1 1 399.608 3.357 10 0 GGAEMO CCN(CC)C(=O)c1ccc(NC(=O)C[N@@H+](C)C2Cc3ccccc3C2)cc1 ZINC000141245559 1417531234 /nfs/dbraw/zinc/53/12/34/1417531234.db2.gz CPNBPJKIGZHIMI-UHFFFAOYSA-N 1 1 379.504 3.206 10 0 GGAEMO CN(C(=O)[C@H]1COc2ccccc2C1)[C@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000178878660 1429207738 /nfs/dbraw/zinc/20/77/38/1429207738.db2.gz CNDONKNTIJRKCS-FCEUIQTBSA-N 1 1 399.579 3.033 10 0 GGAEMO COc1ncccc1C[NH2+][C@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1 ZINC000151164010 1417885741 /nfs/dbraw/zinc/88/57/41/1417885741.db2.gz FEWVRCQAOODZNI-MRXNPFEDSA-N 1 1 389.521 3.116 10 0 GGAEMO CC1CCN(c2cccc(NCc3cnc(N4CC[NH+](C)CC4)nc3)c2)CC1 ZINC000151506263 1418006979 /nfs/dbraw/zinc/00/69/79/1418006979.db2.gz BLQZSZWWDUCWBG-UHFFFAOYSA-N 1 1 380.540 3.077 10 0 GGAEMO COc1cc(OC)c(OC)cc1C[NH2+][C@H]1CCN(c2ccc(Cl)cc2)C1=O ZINC000151788091 1418087124 /nfs/dbraw/zinc/08/71/24/1418087124.db2.gz DETOQBUYOXTBFR-INIZCTEOSA-N 1 1 390.867 3.261 10 0 GGAEMO CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)NCc2cccc(Cn3ccnc3)c2)C1 ZINC000152153743 1418158932 /nfs/dbraw/zinc/15/89/32/1418158932.db2.gz DRIIKCIKCZEXHF-HXUWFJFHSA-N 1 1 392.507 3.237 10 0 GGAEMO C[NH+]1CCN(C(=O)c2ccc(NC(=O)[C@@H]3C[C@H]3c3cccc(F)c3F)cc2)CC1 ZINC000152187225 1418168504 /nfs/dbraw/zinc/16/85/04/1418168504.db2.gz BVQDMRCCHNFODO-ZWKOTPCHSA-N 1 1 399.441 3.095 10 0 GGAEMO C[NH+]1CCN(C(=O)c2ccc(NC(=O)[C@H]3C[C@H]3c3cccc(F)c3F)cc2)CC1 ZINC000152187327 1418168792 /nfs/dbraw/zinc/16/87/92/1418168792.db2.gz BVQDMRCCHNFODO-ROUUACIJSA-N 1 1 399.441 3.095 10 0 GGAEMO COCC[N@@H+](C)CCCC1CCN(C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)CC1 ZINC000179305507 1429322344 /nfs/dbraw/zinc/32/23/44/1429322344.db2.gz CSDMULJDMDUXBN-RTWAWAEBSA-N 1 1 391.531 3.462 10 0 GGAEMO CNC(=O)c1cccc(NC(=O)[C@@H](C)[N@H+]2CC=C(c3cccc(C)c3)CC2)c1 ZINC000179402087 1429360469 /nfs/dbraw/zinc/36/04/69/1429360469.db2.gz CZEXEAOJQRGZEZ-QGZVFWFLSA-N 1 1 377.488 3.471 10 0 GGAEMO CNC(=O)c1cccc(NC(=O)[C@@H](C)[N@@H+]2CC=C(c3cccc(C)c3)CC2)c1 ZINC000179402087 1429360471 /nfs/dbraw/zinc/36/04/71/1429360471.db2.gz CZEXEAOJQRGZEZ-QGZVFWFLSA-N 1 1 377.488 3.471 10 0 GGAEMO CCOC(=O)c1sc2nc(C[NH+](C)C)nc(NC[C@H](CC)CCO)c2c1C ZINC000152398884 1422093355 /nfs/dbraw/zinc/09/33/55/1422093355.db2.gz FBDJEGXYPKPUIG-CYBMUJFWSA-N 1 1 394.541 3.059 10 0 GGAEMO CCCCN1CCc2ccc(NCc3cnc(N4CC[NH+](C)CC4)nc3)cc21 ZINC000152488059 1422117682 /nfs/dbraw/zinc/11/76/82/1422117682.db2.gz BOFASZSNEZNLNU-UHFFFAOYSA-N 1 1 380.540 3.003 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CN(Cc1ccncc1)C(=O)Nc1ccccc1C(=O)OC ZINC000153405188 1422517698 /nfs/dbraw/zinc/51/76/98/1422517698.db2.gz FGNJDIBVWNPDGW-SFHVURJKSA-N 1 1 396.491 3.387 10 0 GGAEMO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NC(=O)N1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000154299131 1422868965 /nfs/dbraw/zinc/86/89/65/1422868965.db2.gz BJTYYFOSDPGHJC-SEIRJHJZSA-N 1 1 395.551 3.386 10 0 GGAEMO COC(=O)c1ccc(C)c(NC(=O)[C@@H](C)[N@H+](C)CCOCc2ccccc2)c1 ZINC000154679829 1422999947 /nfs/dbraw/zinc/99/99/47/1422999947.db2.gz CWLXFMDZELVSJU-QGZVFWFLSA-N 1 1 384.476 3.257 10 0 GGAEMO COC(=O)c1ccc(C)c(NC(=O)[C@@H](C)[N@@H+](C)CCOCc2ccccc2)c1 ZINC000154679829 1422999951 /nfs/dbraw/zinc/99/99/51/1422999951.db2.gz CWLXFMDZELVSJU-QGZVFWFLSA-N 1 1 384.476 3.257 10 0 GGAEMO C[C@H](CN1CCN(C)CC1)[NH2+]Cc1cc(Br)cc(C(F)(F)F)c1 ZINC000155896686 1423583614 /nfs/dbraw/zinc/58/36/14/1423583614.db2.gz ANBPFASSXPXMBC-GFCCVEGCSA-N 1 1 394.279 3.193 10 0 GGAEMO CN1CCN(c2ncccc2C[NH2+]Cc2cc(Cl)cc3cccnc32)CC1 ZINC000156449484 1423811590 /nfs/dbraw/zinc/81/15/90/1423811590.db2.gz BMQYDYSGSYYWBL-UHFFFAOYSA-N 1 1 381.911 3.325 10 0 GGAEMO CC(C)c1ccc([C@@H](C)CC(=O)NCCC[N@H+]2CCC[C@@H]2C(=O)N(C)C)cc1 ZINC000158137634 1424176257 /nfs/dbraw/zinc/17/62/57/1424176257.db2.gz AHXGGPYHCZDVKN-GHTZIAJQSA-N 1 1 387.568 3.363 10 0 GGAEMO COc1ccc(Br)c(C[NH2+][C@H]2CCCN(CC(F)(F)F)C2=O)c1 ZINC000158243260 1424205831 /nfs/dbraw/zinc/20/58/31/1424205831.db2.gz DSWGDAIEPRVNDC-ZDUSSCGKSA-N 1 1 395.219 3.101 10 0 GGAEMO COc1ccc(Br)c(C[NH2+][C@@H]2CCCN(CC(F)(F)F)C2=O)c1 ZINC000158243073 1424206168 /nfs/dbraw/zinc/20/61/68/1424206168.db2.gz DSWGDAIEPRVNDC-CYBMUJFWSA-N 1 1 395.219 3.101 10 0 GGAEMO CCCNC(=O)Nc1ccc(CC(=O)N2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000158846120 1424355972 /nfs/dbraw/zinc/35/59/72/1424355972.db2.gz AIIQCVNLHFAIJE-UHFFFAOYSA-N 1 1 394.519 3.105 10 0 GGAEMO CC[N@@H+](C[C@@H](O)c1ccc(C)cc1)[C@@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000159868613 1424545780 /nfs/dbraw/zinc/54/57/80/1424545780.db2.gz GLWJAGSIMXZXJA-HRAATJIYSA-N 1 1 383.492 3.336 10 0 GGAEMO Cc1cc(=O)n(C)cc1NC(=O)N(C)[C@@H]1CC[N@@H+](Cc2ccccc2)[C@H](C)C1 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QFYYWAORPDTSDH-UHFFFAOYSA-N 1 1 388.899 3.096 10 0 GGAEMO Cc1nn(-c2ccncc2)cc1C[NH2+][C@H](Cc1ccccc1)[C@H](O)C(F)(F)F ZINC000680121099 1126105618 /nfs/dbraw/zinc/10/56/18/1126105618.db2.gz QYMJUBHYXDSRSS-MOPGFXCFSA-N 1 1 390.409 3.200 10 0 GGAEMO COc1ccc(C[C@](C)(CO)[NH2+]Cc2c(F)c(F)c(F)c(F)c2F)cc1 ZINC001473839158 1126199546 /nfs/dbraw/zinc/19/95/46/1126199546.db2.gz UEVOQQXXEZTVFL-GOSISDBHSA-N 1 1 375.337 3.474 10 0 GGAEMO O[C@@H]([C@H](Cc1ccccc1)[NH2+]Cc1ccncc1Br)C(F)(F)F ZINC001560100050 1126207585 /nfs/dbraw/zinc/20/75/85/1126207585.db2.gz CWLAWDLZFANXCA-GJZGRUSLSA-N 1 1 389.215 3.468 10 0 GGAEMO C[C@@](CO)(Cc1ccc(F)cc1)[NH2+]Cc1noc(-c2ccc(F)cc2F)n1 ZINC001648466972 1126250745 /nfs/dbraw/zinc/25/07/45/1126250745.db2.gz SXGJLTNKEVJDRI-IBGZPJMESA-N 1 1 377.366 3.237 10 0 GGAEMO CC(C)c1nsc(C[NH2+][C@]2(CO)CCc3cc(Br)ccc3C2)n1 ZINC001659421695 1126263420 /nfs/dbraw/zinc/26/34/20/1126263420.db2.gz SASPSAYJWDHRAL-QGZVFWFLSA-N 1 1 396.354 3.434 10 0 GGAEMO 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ZINC000025410875 207302834 /nfs/dbraw/zinc/30/28/34/207302834.db2.gz RPPFJUREURQDAI-HZPDHXFCSA-N 1 1 384.480 3.272 10 0 GGAEMO CC[N@H+](CC(=O)N1CCN(c2cccc(C)c2)CC1)Cc1ccc(OC)c(F)c1 ZINC000029064951 207356261 /nfs/dbraw/zinc/35/62/61/207356261.db2.gz VPZTZBSSKQYDOR-UHFFFAOYSA-N 1 1 399.510 3.313 10 0 GGAEMO CC[N@@H+](CC(=O)N1CCN(c2cccc(C)c2)CC1)Cc1ccc(OC)c(F)c1 ZINC000029064951 207356268 /nfs/dbraw/zinc/35/62/68/207356268.db2.gz VPZTZBSSKQYDOR-UHFFFAOYSA-N 1 1 399.510 3.313 10 0 GGAEMO C[C@H]1C[N@H+](Cc2ccc(C(=O)NC[C@@H]3CCN(c4ccccc4)C3)cc2)CCO1 ZINC000031235204 207379988 /nfs/dbraw/zinc/37/99/88/207379988.db2.gz BRIOEUPRJXFHTF-FPOVZHCZSA-N 1 1 393.531 3.164 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccc(C(=O)NC[C@@H]3CCN(c4ccccc4)C3)cc2)CCO1 ZINC000031235204 207379995 /nfs/dbraw/zinc/37/99/95/207379995.db2.gz BRIOEUPRJXFHTF-FPOVZHCZSA-N 1 1 393.531 3.164 10 0 GGAEMO COc1ccc(C[N@H+]2CCCN(C(=O)/C=C/c3ccc4c(c3)CCO4)CC2)cc1 ZINC000040080085 207573568 /nfs/dbraw/zinc/57/35/68/207573568.db2.gz ZQVGTOHCEFKBCJ-UXBLZVDNSA-N 1 1 392.499 3.378 10 0 GGAEMO CC[NH+]1CCN(C(=O)C2(c3ccc(NC(=O)C4CC4)cc3)CCCCC2)CC1 ZINC000065027470 207829462 /nfs/dbraw/zinc/82/94/62/207829462.db2.gz XHHNMMMSBUOMQI-UHFFFAOYSA-N 1 1 383.536 3.401 10 0 GGAEMO O=C([C@@H]1CCCC[C@@H]1C(=O)N1CCc2ccccc21)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC000069532950 207929039 /nfs/dbraw/zinc/92/90/39/207929039.db2.gz NBHQIJSEWLMMLP-NJYVYQBISA-N 1 1 395.547 3.079 10 0 GGAEMO O=C(CCC1CCCC1)N1CCC[N@@H+]([C@@H]2CCN(Cc3ccccc3)C2=O)CC1 ZINC000085824360 208103359 /nfs/dbraw/zinc/10/33/59/208103359.db2.gz FHTKKISPVDAWJX-JOCHJYFZSA-N 1 1 397.563 3.292 10 0 GGAEMO O=C(CCC1CCCC1)N1CCC[N@H+]([C@@H]2CCN(Cc3ccccc3)C2=O)CC1 ZINC000085824360 208103363 /nfs/dbraw/zinc/10/33/63/208103363.db2.gz FHTKKISPVDAWJX-JOCHJYFZSA-N 1 1 397.563 3.292 10 0 GGAEMO CC[NH+](CC)[C@H](C(=O)NCC(=O)NC(C)(C)C)c1cc(Cl)cc(Cl)c1 ZINC000089967839 208111173 /nfs/dbraw/zinc/11/11/73/208111173.db2.gz MWMURQDEXXHRSA-INIZCTEOSA-N 1 1 388.339 3.407 10 0 GGAEMO CC[NH+](CC)[C@@H](C(=O)NCCCC(=O)OC)c1cc(Cl)cc(Cl)c1 ZINC000089967848 208112654 /nfs/dbraw/zinc/11/26/54/208112654.db2.gz QQAMNRZKKDFMBR-MRXNPFEDSA-N 1 1 375.296 3.446 10 0 GGAEMO CCN1CC[C@]2(CN(Cc3[nH]c4ccc(C)cc4c3C)CC[N@H+]2C)CCC1=O ZINC000091326866 208113404 /nfs/dbraw/zinc/11/34/04/208113404.db2.gz WCNCUKHRBASGJE-QHCPKHFHSA-N 1 1 382.552 3.303 10 0 GGAEMO CCN1CC[C@]2(C[N@H+](Cc3[nH]c4ccc(C)cc4c3C)CCN2C)CCC1=O ZINC000091326866 208113413 /nfs/dbraw/zinc/11/34/13/208113413.db2.gz WCNCUKHRBASGJE-QHCPKHFHSA-N 1 1 382.552 3.303 10 0 GGAEMO CCN1CC[C@]2(C[N@@H+](Cc3[nH]c4ccc(C)cc4c3C)CCN2C)CCC1=O ZINC000091326866 208113417 /nfs/dbraw/zinc/11/34/17/208113417.db2.gz WCNCUKHRBASGJE-QHCPKHFHSA-N 1 1 382.552 3.303 10 0 GGAEMO CC(C)[N@@H+](C)Cc1ccc(CNC(=O)c2cccc3c2O[C@H](C)C(=O)N3)cc1 ZINC000095350968 208157729 /nfs/dbraw/zinc/15/77/29/208157729.db2.gz RRDINKIVQMQYAK-OAHLLOKOSA-N 1 1 381.476 3.176 10 0 GGAEMO Cc1cc(C(=O)Nc2c[nH+]ccc2-n2cccn2)c2nc3n(c2n1)CCCCC3 ZINC000095394718 208178712 /nfs/dbraw/zinc/17/87/12/208178712.db2.gz UFXXSVIRAOYCNN-UHFFFAOYSA-N 1 1 387.447 3.299 10 0 GGAEMO c1ccc(-c2noc(CCC[N@@H+](CCN3CCOCC3)C3CCCC3)n2)cc1 ZINC000095446686 208182864 /nfs/dbraw/zinc/18/28/64/208182864.db2.gz XLEZOIBKRPGLHU-UHFFFAOYSA-N 1 1 384.524 3.246 10 0 GGAEMO Cc1ccc(NC(=O)[C@@H]2CSCN2C(=O)C=C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1C ZINC000095451512 208184721 /nfs/dbraw/zinc/18/47/21/208184721.db2.gz GLXIUFFXFIUNOL-ZCNNSNEGSA-N 1 1 399.560 3.326 10 0 GGAEMO C[N@H+]1CC[C@@H]2CCN(C(=O)CCCOc3ccccc3Br)[C@@H]2C1 ZINC000095466169 208189444 /nfs/dbraw/zinc/18/94/44/208189444.db2.gz XUVWVRZVZAWBGP-GDBMZVCRSA-N 1 1 381.314 3.161 10 0 GGAEMO CC[NH+](CC)[C@@H](C(=O)OCCCc1nc2nc(C)cc(C)n2n1)c1ccccc1 ZINC000095468939 208190658 /nfs/dbraw/zinc/19/06/58/208190658.db2.gz URPDEENXVLGBAI-HXUWFJFHSA-N 1 1 395.507 3.300 10 0 GGAEMO CN(CCC[NH+]1CCN(C)CC1)C(=O)c1csc(-c2cc3ccccc3o2)n1 ZINC000095957421 208243854 /nfs/dbraw/zinc/24/38/54/208243854.db2.gz DXJFAZNVUQOCMZ-UHFFFAOYSA-N 1 1 398.532 3.266 10 0 GGAEMO O=C(Nc1ccnn1Cc1cccs1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000095525859 208223170 /nfs/dbraw/zinc/22/31/70/208223170.db2.gz VLJWPQQSOXBNKM-UHFFFAOYSA-N 1 1 381.505 3.343 10 0 GGAEMO C[N@@H+](CCCNC(=O)/C=C\c1ccc(N2CCCC2=O)cc1)Cc1ccccc1 ZINC000096943922 208332054 /nfs/dbraw/zinc/33/20/54/208332054.db2.gz YRQNJOIQNYNCPD-QINSGFPZSA-N 1 1 391.515 3.465 10 0 GGAEMO COc1ccccc1[C@@H](CNC(=O)/C=C\c1cnn(-c2ccccc2)c1)[NH+](C)C ZINC000096943704 208332215 /nfs/dbraw/zinc/33/22/15/208332215.db2.gz YFYWPEVWQOXYTA-DZFTYQQFSA-N 1 1 390.487 3.313 10 0 GGAEMO O=C(NCCC[NH+]1CCOCC1)N1CCCC[C@@H]1c1nc2ccccc2s1 ZINC000096998503 208332744 /nfs/dbraw/zinc/33/27/44/208332744.db2.gz DMYQILNVMGYLFQ-QGZVFWFLSA-N 1 1 388.537 3.255 10 0 GGAEMO O=C(NCCC[NH+]1CCOCC1)N1CCCC[C@H]1c1nc2ccccc2s1 ZINC000096998499 208333044 /nfs/dbraw/zinc/33/30/44/208333044.db2.gz DMYQILNVMGYLFQ-KRWDZBQOSA-N 1 1 388.537 3.255 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)Nc2cccc(-c3noc(C)n3)c2)C[C@H]1CC ZINC000097164677 208339731 /nfs/dbraw/zinc/33/97/31/208339731.db2.gz LBHGZMJLMNNWGN-GOSISDBHSA-N 1 1 387.484 3.010 10 0 GGAEMO C[C@@H]1C[C@@H](NC(=O)/C=C\c2cc(Cl)c3c(c2)OCCCO3)C[N@H+]1C1CC1 ZINC000229439119 209002767 /nfs/dbraw/zinc/00/27/67/209002767.db2.gz GXBTXOZAHFRPBR-DFCLBCNGSA-N 1 1 376.884 3.256 10 0 GGAEMO COCC[N@@H+]1CCC[C@@H]1CN[C@@H](C)c1cnccc1NC(=O)OC(C)(C)C ZINC000241590532 209019172 /nfs/dbraw/zinc/01/91/72/209019172.db2.gz PFOPCHLPKUBFQB-JKSUJKDBSA-N 1 1 378.517 3.190 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CN[C@@H](C)c1cnccc1NC(=O)OC(C)(C)C ZINC000241590532 209019176 /nfs/dbraw/zinc/01/91/76/209019176.db2.gz PFOPCHLPKUBFQB-JKSUJKDBSA-N 1 1 378.517 3.190 10 0 GGAEMO CCOc1ccccc1-c1cccc(C(=O)N2CC[C@@H]([N@@H+](C)CCO)[C@H]2C)c1 ZINC000253419679 209041566 /nfs/dbraw/zinc/04/15/66/209041566.db2.gz FTIKNPQNTUMYED-DYESRHJHSA-N 1 1 382.504 3.279 10 0 GGAEMO Cc1cccc(N2CC[NH+](CCNC(=O)c3cc4sccc4n3C)CC2)c1C ZINC000058060829 136154287 /nfs/dbraw/zinc/15/42/87/136154287.db2.gz CIBHIZXBAVNOLP-UHFFFAOYSA-N 1 1 396.560 3.409 10 0 GGAEMO Cc1cc(Nc2ccc(NC(=O)c3ccco3)cc2)nc(N2CCOCC2)[nH+]1 ZINC000064801109 136157860 /nfs/dbraw/zinc/15/78/60/136157860.db2.gz PDAVXWMHYAIPNI-UHFFFAOYSA-N 1 1 379.420 3.211 10 0 GGAEMO CCCc1nc(C)cc(N2CCC([N@H+]3CC[C@](O)(c4ccccc4)C3)CC2)n1 ZINC000095369610 136178432 /nfs/dbraw/zinc/17/84/32/136178432.db2.gz OHYVRWLSFNIHLA-HSZRJFAPSA-N 1 1 380.536 3.300 10 0 GGAEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc(-c2ccnc(N3CCCC3)n2)cc1 ZINC000065171685 222105814 /nfs/dbraw/zinc/10/58/14/222105814.db2.gz GZEATJHODSKWPJ-SFHVURJKSA-N 1 1 393.535 3.348 10 0 GGAEMO CC(C)Cn1c(-c2cccc(C(=O)N3CC[NH+](C)CC3)c2)nc2cccnc21 ZINC000065172749 222106244 /nfs/dbraw/zinc/10/62/44/222106244.db2.gz UVBMJLNAKXJTGH-UHFFFAOYSA-N 1 1 377.492 3.142 10 0 GGAEMO CCOC(=O)C1=C(C[NH2+]Cc2ccc(Cl)cc2)NC(=O)N[C@H]1c1ccccc1 ZINC000058056272 520520626 /nfs/dbraw/zinc/52/06/26/520520626.db2.gz LSIRHLISMIBJTB-IBGZPJMESA-N 1 1 399.878 3.301 10 0 GGAEMO CCn1c(C[NH2+]Cc2ccc(N3C[C@H](C)O[C@@H](C)C3)nc2)nc2ccccc21 ZINC000054175220 535984080 /nfs/dbraw/zinc/98/40/80/535984080.db2.gz CRGNRGPGWSKYHT-IRXDYDNUSA-N 1 1 379.508 3.355 10 0 GGAEMO CC[C@@H]1CN(C(=O)CCc2cc(Br)cs2)CC[N@H+]1CCOC ZINC000117299168 564225239 /nfs/dbraw/zinc/22/52/39/564225239.db2.gz IYLSUSLNPKRQSM-CQSZACIVSA-N 1 1 389.359 3.012 10 0 GGAEMO C[NH+](C)C[C@H](NS(=O)(=O)c1ccc(Br)s1)c1ccccc1 ZINC000030499612 564381537 /nfs/dbraw/zinc/38/15/37/564381537.db2.gz WKGSVSDRAGOWIP-LBPRGKRZSA-N 1 1 389.340 3.092 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc(F)cc1I ZINC000047144272 564514620 /nfs/dbraw/zinc/51/46/20/564514620.db2.gz NAGBBBLCFIJMGS-LLVKDONJSA-N 1 1 390.240 3.035 10 0 GGAEMO C[N@H+](Cc1cc(Br)c([O-])c(Br)c1)C[C@@H]1CC[NH+](C)C1 ZINC000234350625 565934845 /nfs/dbraw/zinc/93/48/45/565934845.db2.gz HXVOWCCWBREOLL-SNVBAGLBSA-N 1 1 392.135 3.301 10 0 GGAEMO C[NH+](Cc1cc(Br)c([O-])c(Br)c1)C[C@@H]1CC[N@H+](C)C1 ZINC000234350625 565934850 /nfs/dbraw/zinc/93/48/50/565934850.db2.gz HXVOWCCWBREOLL-SNVBAGLBSA-N 1 1 392.135 3.301 10 0 GGAEMO C[NH+](Cc1cc(Br)c([O-])c(Br)c1)C[C@@H]1CC[N@@H+](C)C1 ZINC000234350625 565934856 /nfs/dbraw/zinc/93/48/56/565934856.db2.gz HXVOWCCWBREOLL-SNVBAGLBSA-N 1 1 392.135 3.301 10 0 GGAEMO C[N@H+](Cc1cc(Br)c([O-])c(Br)c1)C[C@H]1CC[NH+](C)C1 ZINC000234323322 565935687 /nfs/dbraw/zinc/93/56/87/565935687.db2.gz HXVOWCCWBREOLL-JTQLQIEISA-N 1 1 392.135 3.301 10 0 GGAEMO C[NH+](Cc1cc(Br)c([O-])c(Br)c1)C[C@H]1CC[N@H+](C)C1 ZINC000234323322 565935690 /nfs/dbraw/zinc/93/56/90/565935690.db2.gz HXVOWCCWBREOLL-JTQLQIEISA-N 1 1 392.135 3.301 10 0 GGAEMO C[NH+](Cc1cc(Br)c([O-])c(Br)c1)C[C@H]1CC[N@@H+](C)C1 ZINC000234323322 565935694 /nfs/dbraw/zinc/93/56/94/565935694.db2.gz HXVOWCCWBREOLL-JTQLQIEISA-N 1 1 392.135 3.301 10 0 GGAEMO CC[N@@H+](CC(=O)NCc1cc(Cl)ccc1I)C1CC1 ZINC000597899002 567723338 /nfs/dbraw/zinc/72/33/38/567723338.db2.gz VIHCJERRBNMYBV-UHFFFAOYSA-N 1 1 392.668 3.045 10 0 GGAEMO CC(C)n1cc2c3c1cccc3[C@H]1C[C@@H](C(=O)O[C@H](C)[C@H](C)O)C[N@H+](C)[C@@H]1C2 ZINC000009224254 560211189 /nfs/dbraw/zinc/21/11/89/560211189.db2.gz JQYLIGHHVGCTPR-HFVSKKSMSA-N 1 1 384.520 3.495 10 0 in-vitro GGAEMO Cc1ccc(I)c(C(=O)N(C)C[C@H]2CCC[N@@H+](C)C2)c1 ZINC000115432565 564193372 /nfs/dbraw/zinc/19/33/72/564193372.db2.gz ACYAZLMVDRNSGH-ZDUSSCGKSA-N 1 1 386.277 3.013 10 0 GGAEMO C[NH+](C)Cc1cc(CNC(=O)C(=O)c2ccc(Br)cc2)ccc1F ZINC000115415395 564193809 /nfs/dbraw/zinc/19/38/09/564193809.db2.gz XXIVWRCKKCPPMG-UHFFFAOYSA-N 1 1 393.256 3.149 10 0 GGAEMO C[C@@H](CNC(=O)c1[nH]c2ccccc2c1Br)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000115864502 564199199 /nfs/dbraw/zinc/19/91/99/564199199.db2.gz XOFAOEJHTBLRGA-RWMBFGLXSA-N 1 1 394.313 3.158 10 0 GGAEMO C[C@@H](CNC(=O)c1[nH]c2ccccc2c1Br)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000115864502 564199203 /nfs/dbraw/zinc/19/92/03/564199203.db2.gz XOFAOEJHTBLRGA-RWMBFGLXSA-N 1 1 394.313 3.158 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1NC(=O)c1ccccc1Br ZINC000116252923 564206195 /nfs/dbraw/zinc/20/61/95/564206195.db2.gz IHVIXMBSAQMEJX-KSSFIOAISA-N 1 1 388.309 3.485 10 0 GGAEMO C[C@H](NC(=O)C[N@@H+]1CC[C@H](c2cnn(C)c2)C1)c1ccc(Cl)c(Cl)c1 ZINC000116314829 564207535 /nfs/dbraw/zinc/20/75/35/564207535.db2.gz LSTAOJMLWADEKB-JSGCOSHPSA-N 1 1 381.307 3.394 10 0 GGAEMO C[C@H](NC(=O)C[N@H+]1CC[C@H](c2cnn(C)c2)C1)c1ccc(Cl)c(Cl)c1 ZINC000116314829 564207540 /nfs/dbraw/zinc/20/75/40/564207540.db2.gz LSTAOJMLWADEKB-JSGCOSHPSA-N 1 1 381.307 3.394 10 0 GGAEMO Cc1cc(NC(=O)[C@@H](C)[N@H+]2CC[C@H](c3cnn(C)c3)C2)ccc1Br ZINC000116314333 564207673 /nfs/dbraw/zinc/20/76/73/564207673.db2.gz HPHNWMOYNKRFCQ-KGLIPLIRSA-N 1 1 391.313 3.308 10 0 GGAEMO CN(Cc1ccc(Cl)c(Cl)c1)C(=O)C[N@H+]1CC[C@H](c2cnn(C)c2)C1 ZINC000116316662 564207805 /nfs/dbraw/zinc/20/78/05/564207805.db2.gz ZKVBMENTOXZUCP-AWEZNQCLSA-N 1 1 381.307 3.175 10 0 GGAEMO O=C(NCCCc1ccc(Br)cc1F)N1CC[NH+](C2CC2)CC1 ZINC000116570097 564212447 /nfs/dbraw/zinc/21/24/47/564212447.db2.gz YXGANHDETUBYJB-UHFFFAOYSA-N 1 1 384.293 3.010 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)c2csc(-c3cccs3)n2)C[C@@H]1CC ZINC000116768047 564215997 /nfs/dbraw/zinc/21/59/97/564215997.db2.gz SASFJQZFTCZNQC-AWEZNQCLSA-N 1 1 379.551 3.445 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)c2csc(-c3cccs3)n2)C[C@@H]1CC ZINC000116768047 564216000 /nfs/dbraw/zinc/21/60/00/564216000.db2.gz SASFJQZFTCZNQC-AWEZNQCLSA-N 1 1 379.551 3.445 10 0 GGAEMO CC(C)(C[N@@H+]1CCc2ccccc2C1)NS(=O)(=O)c1ccc(Cl)cc1 ZINC000005497165 564216190 /nfs/dbraw/zinc/21/61/90/564216190.db2.gz LWWPJRYUNFTHPP-UHFFFAOYSA-N 1 1 378.925 3.455 10 0 GGAEMO CC(C)(C[N@H+]1CCc2ccccc2C1)NS(=O)(=O)c1ccc(Cl)cc1 ZINC000005497165 564216193 /nfs/dbraw/zinc/21/61/93/564216193.db2.gz LWWPJRYUNFTHPP-UHFFFAOYSA-N 1 1 378.925 3.455 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)c2cc3cc(Br)ccc3[nH]2)C[C@H]1C ZINC000117282180 564225223 /nfs/dbraw/zinc/22/52/23/564225223.db2.gz GMCDOLNEQAXYNC-CYBMUJFWSA-N 1 1 394.313 3.113 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)c2cc3cc(Br)ccc3[nH]2)C[C@H]1C ZINC000117282180 564225228 /nfs/dbraw/zinc/22/52/28/564225228.db2.gz GMCDOLNEQAXYNC-CYBMUJFWSA-N 1 1 394.313 3.113 10 0 GGAEMO CC[C@@H]1CN(C(=O)[C@@H]2C[C@@H]2c2cccc(Br)c2)CC[N@H+]1CCOC ZINC000117299303 564225336 /nfs/dbraw/zinc/22/53/36/564225336.db2.gz MGBFKFHHFBUZAU-KZNAEPCWSA-N 1 1 395.341 3.122 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)c2[nH]c3ccccc3c2Br)C[C@@H]1C ZINC000117278486 564225439 /nfs/dbraw/zinc/22/54/39/564225439.db2.gz LTMSWUJLPKBUKH-ZDUSSCGKSA-N 1 1 394.313 3.113 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)c2[nH]c3ccccc3c2Br)C[C@@H]1C ZINC000117278486 564225443 /nfs/dbraw/zinc/22/54/43/564225443.db2.gz LTMSWUJLPKBUKH-ZDUSSCGKSA-N 1 1 394.313 3.113 10 0 GGAEMO CC[C@@H]1CN(C(=O)c2ccc(C3SCCS3)cc2)CC[N@@H+]1CCOC ZINC000117299843 564225667 /nfs/dbraw/zinc/22/56/67/564225667.db2.gz IHUZEQDLBYVNDP-QGZVFWFLSA-N 1 1 380.579 3.348 10 0 GGAEMO CC[C@@H]1CN(C(=O)c2ccc(C3SCCS3)cc2)CC[N@H+]1CCOC ZINC000117299843 564225670 /nfs/dbraw/zinc/22/56/70/564225670.db2.gz IHUZEQDLBYVNDP-QGZVFWFLSA-N 1 1 380.579 3.348 10 0 GGAEMO CC[C@H]1CN(C(=O)CCc2cc(Br)cs2)CC[N@H+]1CCOC ZINC000117299169 564225701 /nfs/dbraw/zinc/22/57/01/564225701.db2.gz IYLSUSLNPKRQSM-AWEZNQCLSA-N 1 1 389.359 3.012 10 0 GGAEMO CC[C@@H]1CN(C(=O)c2cc3c(cccc3Br)[nH]2)CC[N@@H+]1CCOC ZINC000117304502 564225716 /nfs/dbraw/zinc/22/57/16/564225716.db2.gz ZOZDQLMZLKGLLU-CYBMUJFWSA-N 1 1 394.313 3.113 10 0 GGAEMO CC[C@@H]1CN(C(=O)c2cc3c(cccc3Br)[nH]2)CC[N@H+]1CCOC ZINC000117304502 564225718 /nfs/dbraw/zinc/22/57/18/564225718.db2.gz ZOZDQLMZLKGLLU-CYBMUJFWSA-N 1 1 394.313 3.113 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)Nc2ccc(C)cc2Br)C[C@H]1C ZINC000117436065 564227267 /nfs/dbraw/zinc/22/72/67/564227267.db2.gz IWOARTDLPAGINX-CQSZACIVSA-N 1 1 384.318 3.332 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)Nc2ccc(C)cc2Br)C[C@H]1C ZINC000117436065 564227269 /nfs/dbraw/zinc/22/72/69/564227269.db2.gz IWOARTDLPAGINX-CQSZACIVSA-N 1 1 384.318 3.332 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)Nc2ccc(F)cc2Br)C[C@@H]1C ZINC000117444665 564227513 /nfs/dbraw/zinc/22/75/13/564227513.db2.gz RJYYMFUBHVJXQI-LBPRGKRZSA-N 1 1 388.281 3.163 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)Nc2ccc(F)cc2Br)C[C@@H]1C ZINC000117444665 564227515 /nfs/dbraw/zinc/22/75/15/564227515.db2.gz RJYYMFUBHVJXQI-LBPRGKRZSA-N 1 1 388.281 3.163 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)Nc2ccc(Br)cc2C)C[C@@H]1C ZINC000117437425 564227647 /nfs/dbraw/zinc/22/76/47/564227647.db2.gz RDXLEWUOBIXJBR-AWEZNQCLSA-N 1 1 384.318 3.332 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)Nc2ccc(Br)cc2C)C[C@@H]1C ZINC000117437425 564227652 /nfs/dbraw/zinc/22/76/52/564227652.db2.gz RDXLEWUOBIXJBR-AWEZNQCLSA-N 1 1 384.318 3.332 10 0 GGAEMO COCC[N@@H+]1CCN(C(=O)N[C@@H]2CCSc3ccc(Cl)cc32)C[C@H]1C ZINC000117472836 564227680 /nfs/dbraw/zinc/22/76/80/564227680.db2.gz IQJYDXKELNJQDR-CZUORRHYSA-N 1 1 383.945 3.239 10 0 GGAEMO COCC[N@H+]1CCN(C(=O)N[C@@H]2CCSc3ccc(Cl)cc32)C[C@H]1C ZINC000117472836 564227683 /nfs/dbraw/zinc/22/76/83/564227683.db2.gz IQJYDXKELNJQDR-CZUORRHYSA-N 1 1 383.945 3.239 10 0 GGAEMO CC[C@@H]1CN(C(=O)Nc2ccc(F)cc2Br)CC[N@H+]1CCOC ZINC000117444659 564227857 /nfs/dbraw/zinc/22/78/57/564227857.db2.gz BPEGQCKOLJVVEO-CYBMUJFWSA-N 1 1 388.281 3.163 10 0 GGAEMO Cc1c[nH+]c(N[C@H](CO)c2ccsc2)nc1N[C@@H](CO)c1ccsc1 ZINC000472646847 564229763 /nfs/dbraw/zinc/22/97/63/564229763.db2.gz CSFCVYJYKNNQLP-LSDHHAIUSA-N 1 1 376.507 3.199 10 0 GGAEMO CC[NH+]1CCN(c2ccccc2NS(=O)(=O)c2ccccc2Cl)CC1 ZINC000007109294 564233122 /nfs/dbraw/zinc/23/31/22/564233122.db2.gz BZDMKYUIZRHBEP-UHFFFAOYSA-N 1 1 379.913 3.283 10 0 GGAEMO C[N@@H+](Cc1ccc(F)cc1)Cc1cc(=O)n2cc(Br)ccc2n1 ZINC000008120262 564246411 /nfs/dbraw/zinc/24/64/11/564246411.db2.gz CHMTYBJYGZTNNV-UHFFFAOYSA-N 1 1 376.229 3.228 10 0 GGAEMO Cc1c(I)cccc1C(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000119132847 564256307 /nfs/dbraw/zinc/25/63/07/564256307.db2.gz YCIYQKUIGUQZRD-YPMHNXCESA-N 1 1 386.277 3.154 10 0 GGAEMO COCC[N@@H+]1CCN(Cc2ncc(-c3ccccc3Br)o2)C[C@H]1C ZINC000119159438 564257433 /nfs/dbraw/zinc/25/74/33/564257433.db2.gz ZFPPTFMCOVZGLW-CQSZACIVSA-N 1 1 394.313 3.257 10 0 GGAEMO COCC[N@H+]1CCN(Cc2ncc(-c3ccccc3Br)o2)C[C@H]1C ZINC000119159438 564257438 /nfs/dbraw/zinc/25/74/38/564257438.db2.gz ZFPPTFMCOVZGLW-CQSZACIVSA-N 1 1 394.313 3.257 10 0 GGAEMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1ccccc1I ZINC000119352787 564266693 /nfs/dbraw/zinc/26/66/93/564266693.db2.gz YCLDIGKWGCALTJ-CYBMUJFWSA-N 1 1 386.277 3.141 10 0 GGAEMO COc1ccc(C(=O)[C@@H]2CCC[N@H+](C3CSCCSC3)C2)cc1OC ZINC000013594044 564276994 /nfs/dbraw/zinc/27/69/94/564276994.db2.gz BILTUKQTNXCODY-OAHLLOKOSA-N 1 1 381.563 3.447 10 0 GGAEMO Cc1cccc(C(=O)N2CCC([N@@H+]3CCO[C@H](C)C3)CC2)c1Br ZINC000119636101 564280249 /nfs/dbraw/zinc/28/02/49/564280249.db2.gz PHSGVZQGJWFROR-CQSZACIVSA-N 1 1 381.314 3.083 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)Nc2ccccc2Br)C[C@H]1CC ZINC000119649520 564281234 /nfs/dbraw/zinc/28/12/34/564281234.db2.gz DFMOXUWONKMLAZ-CQSZACIVSA-N 1 1 384.318 3.414 10 0 GGAEMO CC(C)[N@@H+](CC(=O)N(C)Cc1ccccc1Br)C1CCOCC1 ZINC000119664714 564282149 /nfs/dbraw/zinc/28/21/49/564282149.db2.gz PAZINRHDXXYMBP-UHFFFAOYSA-N 1 1 383.330 3.297 10 0 GGAEMO COc1ccsc1S(=O)(=O)NC[C@]1(C)CCC[N@@H+]1Cc1ccccc1 ZINC000119697432 564284016 /nfs/dbraw/zinc/28/40/16/564284016.db2.gz FTCWSBHPWCOGHF-SFHVURJKSA-N 1 1 380.535 3.090 10 0 GGAEMO COc1ccsc1S(=O)(=O)NC[C@]1(C)CCC[N@H+]1Cc1ccccc1 ZINC000119697432 564284021 /nfs/dbraw/zinc/28/40/21/564284021.db2.gz FTCWSBHPWCOGHF-SFHVURJKSA-N 1 1 380.535 3.090 10 0 GGAEMO COc1ccc(CNCc2n[nH]c(-c3ccc(Br)cc3)n2)cc1O ZINC000119724701 564284746 /nfs/dbraw/zinc/28/47/46/564284746.db2.gz ZNMVJOFULGYAAT-UHFFFAOYSA-N 1 1 389.253 3.238 10 0 GGAEMO CCCn1cc(CNCc2n[nH]c(-c3ccc(Br)cc3)n2)cn1 ZINC000119738389 564286213 /nfs/dbraw/zinc/28/62/13/564286213.db2.gz PARDNATYGTYSKF-UHFFFAOYSA-N 1 1 375.274 3.131 10 0 GGAEMO Cc1cc(S(=O)(=O)N2CCC(Cc3[nH+]ccn3C)CC2)c(Cl)cc1F ZINC000119766993 564287287 /nfs/dbraw/zinc/28/72/87/564287287.db2.gz OWGGDFXFBIRNMO-UHFFFAOYSA-N 1 1 385.892 3.164 10 0 GGAEMO Cn1cc[nH+]c1CC1CCN(S(=O)(=O)c2cc(Cl)cc(Cl)c2)CC1 ZINC000119778375 564287676 /nfs/dbraw/zinc/28/76/76/564287676.db2.gz NPUDFIHZXVFXKX-UHFFFAOYSA-N 1 1 388.320 3.370 10 0 GGAEMO C[N@H+](Cc1cc(O)ccc1Br)[C@@H]1CCCN(c2cccnn2)C1 ZINC000120241558 564310717 /nfs/dbraw/zinc/31/07/17/564310717.db2.gz IAVVWTJRUJZHKB-CQSZACIVSA-N 1 1 377.286 3.046 10 0 GGAEMO C[N@@H+](Cc1cc(O)ccc1Br)[C@@H]1CCCN(c2cccnn2)C1 ZINC000120241558 564310720 /nfs/dbraw/zinc/31/07/20/564310720.db2.gz IAVVWTJRUJZHKB-CQSZACIVSA-N 1 1 377.286 3.046 10 0 GGAEMO COc1ccccc1CNC(=O)C[NH2+][C@@H](C)c1ccccc1Br ZINC000120529801 564324711 /nfs/dbraw/zinc/32/47/11/564324711.db2.gz QHUHDSIZRDNZOG-ZDUSSCGKSA-N 1 1 377.282 3.425 10 0 GGAEMO Cc1ccc(I)c(C(=O)N(C)[C@@H]2CC[N@H+](C)C[C@@H]2C)c1 ZINC000120571620 564326978 /nfs/dbraw/zinc/32/69/78/564326978.db2.gz KDWYQASBGFCEIE-SWLSCSKDSA-N 1 1 386.277 3.012 10 0 GGAEMO CCOCC[N@H+]1CCN(CC2=Cc3cc(Br)ccc3OC2)C[C@@H]1C ZINC000120893137 564342494 /nfs/dbraw/zinc/34/24/94/564342494.db2.gz PDALFMIGKKXKQM-HNNXBMFYSA-N 1 1 395.341 3.268 10 0 GGAEMO CC[C@H]1CN(Cc2cc(Br)c(OC)s2)CC[N@H+]1CCOC ZINC000120925537 564342856 /nfs/dbraw/zinc/34/28/56/564342856.db2.gz BVVZOOJNZQLILW-LBPRGKRZSA-N 1 1 377.348 3.062 10 0 GGAEMO CCCOc1ccc(Br)cc1C[N@@H+]1CC[C@@H](N2CCOCC2)C1 ZINC000120977128 564347219 /nfs/dbraw/zinc/34/72/19/564347219.db2.gz YTALJQVHVRICMZ-QGZVFWFLSA-N 1 1 383.330 3.144 10 0 GGAEMO CCCOc1ccc(Br)cc1C[N@H+]1CC[C@@H](N2CCOCC2)C1 ZINC000120977128 564347220 /nfs/dbraw/zinc/34/72/20/564347220.db2.gz YTALJQVHVRICMZ-QGZVFWFLSA-N 1 1 383.330 3.144 10 0 GGAEMO CC(C)C[N@H+]1CCO[C@H](CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2Cl)C1 ZINC000028013374 564358765 /nfs/dbraw/zinc/35/87/65/564358765.db2.gz VYSGYBKWBMMFSF-UKRRQHHQSA-N 1 1 389.323 3.234 10 0 GGAEMO CC(C)(CNc1cc[nH+]c(N2CCOCC2)n1)c1cccc(Br)c1 ZINC000543691682 564359947 /nfs/dbraw/zinc/35/99/47/564359947.db2.gz GGTQWGILVPSVSO-UHFFFAOYSA-N 1 1 391.313 3.465 10 0 GGAEMO COCC[N@@H+]1CCN(C(=O)C[C@@H](C)c2ccc(Br)cc2)C[C@@H]1C ZINC000121586052 564375659 /nfs/dbraw/zinc/37/56/59/564375659.db2.gz ZVFLMGKEMQLHGJ-CABCVRRESA-N 1 1 383.330 3.122 10 0 GGAEMO 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C[C@@H](CNC(=O)c1ccc(Br)cc1Cl)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000052588035 564574463 /nfs/dbraw/zinc/57/44/63/564574463.db2.gz XSGRZOIHAAIZAV-SDDRHHMPSA-N 1 1 389.721 3.330 10 0 GGAEMO C[C@@H](CNC(=O)c1ccc(Br)cc1Cl)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000052588035 564574467 /nfs/dbraw/zinc/57/44/67/564574467.db2.gz XSGRZOIHAAIZAV-SDDRHHMPSA-N 1 1 389.721 3.330 10 0 GGAEMO Cc1c(I)cccc1C(=O)N[C@@H]1C[N@@H+](C(C)C)C[C@@H]1C ZINC000127359641 564582019 /nfs/dbraw/zinc/58/20/19/564582019.db2.gz HLXIUKPSFSSZJH-XHDPSFHLSA-N 1 1 386.277 3.058 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CNC(=S)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000053537738 564590089 /nfs/dbraw/zinc/59/00/89/564590089.db2.gz YAULMRJFSSUCQG-DZGCQCFKSA-N 1 1 398.370 3.221 10 0 GGAEMO Cc1nn2c(nc(C[N@@H+](C)CCCOc3ccc(Cl)cc3)cc2=O)s1 ZINC000053681847 564593130 /nfs/dbraw/zinc/59/31/30/564593130.db2.gz NMEWQMPDTGKSMI-UHFFFAOYSA-N 1 1 378.885 3.014 10 0 GGAEMO Cc1ccc(Br)cc1NC(=O)C1CC[NH+](Cc2nccn2C)CC1 ZINC000053998092 564597126 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O[C@]12CCCC[C@@H]1C[N@@H+](Cc1nnc(-c3ccc(Br)o3)o1)CC2 ZINC000128555570 564622021 /nfs/dbraw/zinc/62/20/21/564622021.db2.gz YAKSYDFTMKNQSL-BZNIZROVSA-N 1 1 382.258 3.219 10 0 GGAEMO O[C@@]12CCCC[C@@H]1C[N@H+](Cc1nnc(-c3ccc(Br)o3)o1)CC2 ZINC000128555308 564622132 /nfs/dbraw/zinc/62/21/32/564622132.db2.gz YAKSYDFTMKNQSL-BDJLRTHQSA-N 1 1 382.258 3.219 10 0 GGAEMO O[C@@]12CCCC[C@@H]1C[N@@H+](Cc1nnc(-c3ccc(Br)o3)o1)CC2 ZINC000128555308 564622134 /nfs/dbraw/zinc/62/21/34/564622134.db2.gz YAKSYDFTMKNQSL-BDJLRTHQSA-N 1 1 382.258 3.219 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)Nc1ccc(Br)c(C)n1 ZINC000128712445 564627518 /nfs/dbraw/zinc/62/75/18/564627518.db2.gz TYTTZHYPLZTYBJ-CYBMUJFWSA-N 1 1 378.274 3.354 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)NCc2ccc(OC)c(Br)c2)[C@H](C)C1 ZINC000128894001 564632938 /nfs/dbraw/zinc/63/29/38/564632938.db2.gz PYZVHZVNNKEUGW-CZUORRHYSA-N 1 1 398.345 3.329 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1S(=O)(=O)Cc1ccc(Cl)cc1Cl ZINC000129371665 564646694 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CCN(CC)C(=O)C1CC[NH+](Cc2cn3cc(Br)ccc3n2)CC1 ZINC000058524296 564685217 /nfs/dbraw/zinc/68/52/17/564685217.db2.gz MDESVAMJYZCPLP-UHFFFAOYSA-N 1 1 393.329 3.177 10 0 GGAEMO C[C@H]1CCCC[N@H+]1CCNS(=O)(=O)c1ccc(Br)cc1Cl ZINC000058561842 564685689 /nfs/dbraw/zinc/68/56/89/564685689.db2.gz ZMGPFFOTWFVLPK-NSHDSACASA-N 1 1 395.750 3.255 10 0 GGAEMO CN(C)c1nc(NC[C@H]2CCN(c3ccc(Br)cc3)C2)cc[nH+]1 ZINC000525363644 564699210 /nfs/dbraw/zinc/69/92/10/564699210.db2.gz RGLLVIXQCBIYRP-CYBMUJFWSA-N 1 1 376.302 3.244 10 0 GGAEMO O=C(CCN1CCC[N@H+](C2CC2)CC1)Nc1ccc(Br)cc1F ZINC000061040907 564703908 /nfs/dbraw/zinc/70/39/08/564703908.db2.gz WGWCOSNUUKYYKL-UHFFFAOYSA-N 1 1 384.293 3.087 10 0 GGAEMO O=C(CC[N@@H+]1CCCN(C2CC2)CC1)Nc1ccc(Br)cc1F ZINC000061040907 564703911 /nfs/dbraw/zinc/70/39/11/564703911.db2.gz WGWCOSNUUKYYKL-UHFFFAOYSA-N 1 1 384.293 3.087 10 0 GGAEMO O=C(CC[N@H+]1CCCN(C2CC2)CC1)Nc1ccc(Br)cc1F ZINC000061040907 564703914 /nfs/dbraw/zinc/70/39/14/564703914.db2.gz WGWCOSNUUKYYKL-UHFFFAOYSA-N 1 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Cn1ccnc1C[NH+]1CCC(C(=O)Nc2cc(Br)ccc2F)CC1 ZINC000110647036 565043223 /nfs/dbraw/zinc/04/32/23/565043223.db2.gz PRLFRNHTSDNVKX-UHFFFAOYSA-N 1 1 395.276 3.172 10 0 GGAEMO O=C(CC[N@H+]1CC[C@@H](Oc2cccnc2)C1)Nc1ccccc1Br ZINC000154659722 565048193 /nfs/dbraw/zinc/04/81/93/565048193.db2.gz NWQSKDQINIYOSL-OAHLLOKOSA-N 1 1 390.281 3.326 10 0 GGAEMO O=C(CCc1ccccc1Br)N1CCCC[C@@H]1C[NH+]1CCOCC1 ZINC000110954945 565048271 /nfs/dbraw/zinc/04/82/71/565048271.db2.gz QEQWIQMYZAMPFQ-QGZVFWFLSA-N 1 1 395.341 3.095 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)S(=O)(=O)c2ccc(C(F)(F)F)cc2Cl)CC[N@H+]1C ZINC000154698183 565049623 /nfs/dbraw/zinc/04/96/23/565049623.db2.gz ODDTWDNRIZBJDX-PWSUYJOCSA-N 1 1 384.851 3.462 10 0 GGAEMO C[C@H]1C[C@H](N(C)S(=O)(=O)c2ccc(Br)c(Cl)c2)CC[N@H+]1C ZINC000154696801 565049731 /nfs/dbraw/zinc/04/97/31/565049731.db2.gz MUABOXVIZRWDLW-WDEREUQCSA-N 1 1 395.750 3.206 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CN1CCN(Cc2csc(-c3ccsc3)n2)CC1 ZINC000111230920 565050889 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C[C@H](CO)[C@H](C)NC(=O)NC1CC[NH+](Cc2ccc(Cl)c(Cl)c2)CC1 ZINC000154892444 565056315 /nfs/dbraw/zinc/05/63/15/565056315.db2.gz QTBCFTQANXDROX-OLZOCXBDSA-N 1 1 388.339 3.274 10 0 GGAEMO CCC[N@@H+](C[C@@H](O)CN1CCCC1=O)[C@@H](C)c1ccccc1Br ZINC000111684288 565056892 /nfs/dbraw/zinc/05/68/92/565056892.db2.gz DEQVANPCKBZXJA-LSDHHAIUSA-N 1 1 383.330 3.205 10 0 GGAEMO C[C@@H](C(=O)Nc1ccc(Cl)c(Cl)c1)[NH+]1CCC(OCCCO)CC1 ZINC000154944390 565057542 /nfs/dbraw/zinc/05/75/42/565057542.db2.gz NREUABIZLIEYME-LBPRGKRZSA-N 1 1 375.296 3.184 10 0 GGAEMO COc1cccc(Br)c1OC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000154954306 565058186 /nfs/dbraw/zinc/05/81/86/565058186.db2.gz XUJNBVDLEBYASV-INIZCTEOSA-N 1 1 392.293 3.256 10 0 GGAEMO Cc1ccc(Br)cc1NC(=O)c1ccnc(N2CC[NH+](C)CC2)c1 ZINC000112275020 565061526 /nfs/dbraw/zinc/06/15/26/565061526.db2.gz OJOJCXCLQKYYMN-UHFFFAOYSA-N 1 1 389.297 3.157 10 0 GGAEMO C[N@@H+](Cc1cccc(Br)c1)C1CCN(CCn2cccn2)CC1 ZINC000155110565 565062334 /nfs/dbraw/zinc/06/23/34/565062334.db2.gz 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ZINC000155165524 565063406 /nfs/dbraw/zinc/06/34/06/565063406.db2.gz HCSAWHDEUZTIIJ-OAHLLOKOSA-N 1 1 397.338 3.339 10 0 GGAEMO Brc1ccc(-c2c[nH]c(C[NH2+]CCCCN3CCOCC3)n2)cc1 ZINC000112372009 565063616 /nfs/dbraw/zinc/06/36/16/565063616.db2.gz UXLQPNSWVPXMIT-UHFFFAOYSA-N 1 1 393.329 3.041 10 0 GGAEMO CCn1cc(C[N@H+]2CCCN(Cc3cccc(Br)c3)CC2)cn1 ZINC000112731347 565065962 /nfs/dbraw/zinc/06/59/62/565065962.db2.gz JGMMGWABTMDBMA-UHFFFAOYSA-N 1 1 377.330 3.373 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)c2ccc(Br)c(Cl)c2)C[C@H]1C ZINC000155327956 565066250 /nfs/dbraw/zinc/06/62/50/565066250.db2.gz OLIHVVLMRBFERO-GFCCVEGCSA-N 1 1 389.721 3.285 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)c2ccc(Br)c(Cl)c2)C[C@H]1C ZINC000155327956 565066251 /nfs/dbraw/zinc/06/62/51/565066251.db2.gz OLIHVVLMRBFERO-GFCCVEGCSA-N 1 1 389.721 3.285 10 0 GGAEMO Cc1nc(C(=O)N2[C@@H](C)C[NH+](C)C[C@@H]2C)nn1-c1c(Cl)cccc1Cl ZINC000155350347 565066575 /nfs/dbraw/zinc/06/65/75/565066575.db2.gz RUJNFGHVXPZTIB-QWRGUYRKSA-N 1 1 382.295 3.047 10 0 GGAEMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1cc(Br)sc1Br ZINC000155452752 565067657 /nfs/dbraw/zinc/06/76/57/565067657.db2.gz XJHJGVFBDHIRED-HTQZYQBOSA-N 1 1 396.148 3.438 10 0 GGAEMO CCOC(=O)[C@@H]1CCC[N@@H+](C[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000155534218 565068678 /nfs/dbraw/zinc/06/86/78/565068678.db2.gz NRZXTYYBDZDQFM-CHWSQXEVSA-N 1 1 376.280 3.008 10 0 GGAEMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1S(=O)(=O)c1cc(C(F)(F)F)ccc1Cl ZINC000113305423 565069402 /nfs/dbraw/zinc/06/94/02/565069402.db2.gz HBDLBULIPSKRTD-ZYHUDNBSSA-N 1 1 382.835 3.216 10 0 GGAEMO Cc1c(C(=O)N2[C@H](C)C[NH+](C)C[C@H]2C)cnn1-c1cccc(Br)c1 ZINC000155625789 565069974 /nfs/dbraw/zinc/06/99/74/565069974.db2.gz CUBGVMIPMCQYAV-CHWSQXEVSA-N 1 1 391.313 3.108 10 0 GGAEMO Cc1sc2ncnc(SCC(=O)N[C@@H]3C[N@@H+](C(C)C)C[C@@H]3C)c2c1C ZINC000155624442 565070013 /nfs/dbraw/zinc/07/00/13/565070013.db2.gz RVJFBDKGOSWQJS-SMDDNHRTSA-N 1 1 378.567 3.245 10 0 GGAEMO O=C(C[C@H]1C[N@H+](Cc2ccccc2)CCO1)Nc1cncc(Br)c1 ZINC000155879799 565072489 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CN(Cc1ccccc1Br)C(=O)C[N@@H+]1CCCC[C@@H]1c1cn[nH]c1 ZINC000114483303 565074703 /nfs/dbraw/zinc/07/47/03/565074703.db2.gz LEGVSDOTUNJAMC-QGZVFWFLSA-N 1 1 391.313 3.358 10 0 GGAEMO CN(Cc1ccccc1Br)C(=O)C[N@H+]1CCCC[C@@H]1c1cn[nH]c1 ZINC000114483303 565074704 /nfs/dbraw/zinc/07/47/04/565074704.db2.gz LEGVSDOTUNJAMC-QGZVFWFLSA-N 1 1 391.313 3.358 10 0 GGAEMO Cc1ccc(I)cc1C(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000156316162 565080495 /nfs/dbraw/zinc/08/04/95/565080495.db2.gz DRDSIWUDAYPYTL-TZMCWYRMSA-N 1 1 386.277 3.154 10 0 GGAEMO CC[C@H]([NH2+]Cc1sc(C)nc1C(F)(F)F)c1cccc(S(N)(=O)=O)c1 ZINC000183643566 565084837 /nfs/dbraw/zinc/08/48/37/565084837.db2.gz HVURMUBCGDLTKX-LBPRGKRZSA-N 1 1 393.456 3.359 10 0 GGAEMO CCN(CC(F)(F)F)C(=O)[C@@H]1CCC[N@@H+](Cc2c(C)nn(C)c2Cl)C1 ZINC000266583560 565085542 /nfs/dbraw/zinc/08/55/42/565085542.db2.gz IRXGSJJANWZMAN-GFCCVEGCSA-N 1 1 380.842 3.005 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)C(=O)N[C@H]2CCOc3ccc(Br)cc32)CC[N@H+]1C ZINC000266833206 565092896 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CCN(C(=O)C[NH2+][C@@H](CO)c1cccc(Br)c1)C1CCCCC1 ZINC000183885523 565101176 /nfs/dbraw/zinc/10/11/76/565101176.db2.gz LDSZWXBEMBFVKD-KRWDZBQOSA-N 1 1 383.330 3.253 10 0 GGAEMO CN(CC1CCCCC1)C(=O)C[NH2+][C@H](CO)c1cccc(Br)c1 ZINC000183888476 565101596 /nfs/dbraw/zinc/10/15/96/565101596.db2.gz PRIRDSLTQNGMBK-QGZVFWFLSA-N 1 1 383.330 3.111 10 0 GGAEMO CN(CC1CCCCC1)C(=O)C[NH2+][C@@H](CO)c1cccc(Br)c1 ZINC000183888456 565101626 /nfs/dbraw/zinc/10/16/26/565101626.db2.gz PRIRDSLTQNGMBK-KRWDZBQOSA-N 1 1 383.330 3.111 10 0 GGAEMO C[C@@H]1CCC[C@H](NC(=O)C[NH2+][C@@H](CO)c2cccc(Br)c2)[C@@H]1C ZINC000183905805 565102323 /nfs/dbraw/zinc/10/23/23/565102323.db2.gz ZGYBXHXHMBBSJO-OMNBBPDLSA-N 1 1 383.330 3.013 10 0 GGAEMO OC[C@@H]([NH2+]Cc1cncc(Br)c1)c1cccc(Br)c1 ZINC000183908798 565102413 /nfs/dbraw/zinc/10/24/13/565102413.db2.gz KCUMHYKHUFLQMB-CQSZACIVSA-N 1 1 386.087 3.430 10 0 GGAEMO Cc1ccc(NC(=O)C[NH2+][C@H](CO)c2cccc(Br)c2)cc1C ZINC000183919203 565103837 /nfs/dbraw/zinc/10/38/37/565103837.db2.gz NJDMZISLAFFQFM-QGZVFWFLSA-N 1 1 377.282 3.328 10 0 GGAEMO CSc1ccc(NC(=O)C[NH2+][C@@H](CO)c2cccc(Br)c2)cc1 ZINC000183913412 565104688 /nfs/dbraw/zinc/10/46/88/565104688.db2.gz AWYHLSAJSSDPHW-INIZCTEOSA-N 1 1 395.322 3.433 10 0 GGAEMO C[N@H+]1CC[C@]2(CCN(Cc3nc(-c4ccc(Br)s4)no3)C2)C1 ZINC000292214403 565105304 /nfs/dbraw/zinc/10/53/04/565105304.db2.gz UKLTYKJZGQSJJN-HNNXBMFYSA-N 1 1 383.315 3.088 10 0 GGAEMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000267328380 565114442 /nfs/dbraw/zinc/11/44/42/565114442.db2.gz QBLSINQMBZHFRF-XJKSGUPXSA-N 1 1 396.329 3.256 10 0 GGAEMO Cc1cn2c(C[N@@H+]3CCCN(Cc4csc(C)n4)CC3)c(C)nc2s1 ZINC000157255927 565125560 /nfs/dbraw/zinc/12/55/60/565125560.db2.gz GTAVMYMNRYYNSD-UHFFFAOYSA-N 1 1 375.567 3.485 10 0 GGAEMO Cc1cn2c(C[N@H+]3CCCN(Cc4csc(C)n4)CC3)c(C)nc2s1 ZINC000157255927 565125563 /nfs/dbraw/zinc/12/55/63/565125563.db2.gz GTAVMYMNRYYNSD-UHFFFAOYSA-N 1 1 375.567 3.485 10 0 GGAEMO Cc1noc([C@H]2CCC[N@@H+](C[C@@](C)(O)c3ccc(Br)cc3F)C2)n1 ZINC000292689009 565129232 /nfs/dbraw/zinc/12/92/32/565129232.db2.gz AHZYSMZYMYNEFF-YVEFUNNKSA-N 1 1 398.276 3.367 10 0 GGAEMO C[C@H](CCN1CC[NH+](C)CC1)NC(=O)C[C@@H](C)c1ccc(Br)cc1 ZINC000184334373 565129694 /nfs/dbraw/zinc/12/96/94/565129694.db2.gz TVVGOIPYBLVXEK-HZPDHXFCSA-N 1 1 396.373 3.085 10 0 GGAEMO Cc1cnc(CC[N@@H+](C)CC(=O)N(C)Cc2ccccc2Br)s1 ZINC000157595691 565137858 /nfs/dbraw/zinc/13/78/58/565137858.db2.gz UIWVNIFICJXXAR-UHFFFAOYSA-N 1 1 396.354 3.347 10 0 GGAEMO Cc1cnc(CC[N@H+](C)CC(=O)N(C)Cc2ccccc2Br)s1 ZINC000157595691 565137863 /nfs/dbraw/zinc/13/78/63/565137863.db2.gz UIWVNIFICJXXAR-UHFFFAOYSA-N 1 1 396.354 3.347 10 0 GGAEMO Cc1cnc(CC[N@H+](C)C[C@@H](O)COc2ccc(Br)cc2)s1 ZINC000157839106 565145475 /nfs/dbraw/zinc/14/54/75/565145475.db2.gz PHKYFPSKQHGSBA-CQSZACIVSA-N 1 1 385.327 3.128 10 0 GGAEMO CCc1noc(C)c1C[NH2+]Cc1ccc(Br)cc1N1CCOCC1 ZINC000293065300 565149582 /nfs/dbraw/zinc/14/95/82/565149582.db2.gz VBKOSJZSVQXLLR-UHFFFAOYSA-N 1 1 394.313 3.434 10 0 GGAEMO COc1ccsc1S(=O)(=O)N1c2ccc(C)cc2[C@@H]2C[N@H+](C)CC[C@H]21 ZINC000268388409 565149690 /nfs/dbraw/zinc/14/96/90/565149690.db2.gz LPAALUAIXFCKFG-GOEBONIOSA-N 1 1 378.519 3.062 10 0 GGAEMO COc1ccsc1S(=O)(=O)N1c2ccc(C)cc2[C@H]2C[N@H+](C)CC[C@H]21 ZINC000268388404 565149745 /nfs/dbraw/zinc/14/97/45/565149745.db2.gz LPAALUAIXFCKFG-GDBMZVCRSA-N 1 1 378.519 3.062 10 0 GGAEMO CCOc1cc(C[NH2+][C@H](C)c2nnc3ccccn32)cc(Br)c1O ZINC000268459194 565153337 /nfs/dbraw/zinc/15/33/37/565153337.db2.gz OTBSUOYUYWOUNI-LLVKDONJSA-N 1 1 391.269 3.447 10 0 GGAEMO CC[C@H](O)C[NH+]1CCN(C(=O)N[C@H](C)c2cc(F)c(Cl)cc2Cl)CC1 ZINC000184714285 565154060 /nfs/dbraw/zinc/15/40/60/565154060.db2.gz HWNUVWXUZFVWNP-NEPJUHHUSA-N 1 1 392.302 3.292 10 0 GGAEMO COCC[N@@H+]1CCN(C(=O)Nc2cc(F)c(Br)cc2C)C[C@@H]1C ZINC000184836590 565159772 /nfs/dbraw/zinc/15/97/72/565159772.db2.gz NCPREXDROMZXNW-LBPRGKRZSA-N 1 1 388.281 3.081 10 0 GGAEMO COCC[N@H+]1CCN(C(=O)Nc2cc(F)c(Br)cc2C)C[C@@H]1C ZINC000184836590 565159779 /nfs/dbraw/zinc/15/97/79/565159779.db2.gz NCPREXDROMZXNW-LBPRGKRZSA-N 1 1 388.281 3.081 10 0 GGAEMO COCC[N@@H+]1CCN(C(=O)Nc2cc(F)c(Br)cc2C)C[C@H]1C ZINC000184836569 565160021 /nfs/dbraw/zinc/16/00/21/565160021.db2.gz NCPREXDROMZXNW-GFCCVEGCSA-N 1 1 388.281 3.081 10 0 GGAEMO COCC[N@H+]1CCN(C(=O)Nc2cc(F)c(Br)cc2C)C[C@H]1C ZINC000184836569 565160024 /nfs/dbraw/zinc/16/00/24/565160024.db2.gz NCPREXDROMZXNW-GFCCVEGCSA-N 1 1 388.281 3.081 10 0 GGAEMO C[N@@H+](CCCO)C1CCN(C(=O)N[C@H]2CCCc3sc(Cl)cc32)CC1 ZINC000293432216 565167854 /nfs/dbraw/zinc/16/78/54/565167854.db2.gz OJXIWGIDODTUPH-HNNXBMFYSA-N 1 1 385.961 3.267 10 0 GGAEMO CCCCNC(=O)C1CC[NH+](Cc2nc3cc(Br)ccc3[nH]2)CC1 ZINC000184966335 565168720 /nfs/dbraw/zinc/16/87/20/565168720.db2.gz WFVJIMUXELCPBD-UHFFFAOYSA-N 1 1 393.329 3.454 10 0 GGAEMO Brc1ccc2[nH]c(C[NH+]3CCC(OC[C@@H]4CCCO4)CC3)nc2c1 ZINC000184980056 565168738 /nfs/dbraw/zinc/16/87/38/565168738.db2.gz CMKDKNHUQQPCIF-HNNXBMFYSA-N 1 1 394.313 3.485 10 0 GGAEMO CCO[C@@H]1C[C@@H](O)C12CC[NH+](Cc1nc3cc(Br)ccc3[nH]1)CC2 ZINC000184974154 565169687 /nfs/dbraw/zinc/16/96/87/565169687.db2.gz VNTZVAFLDONMOC-HZPDHXFCSA-N 1 1 394.313 3.077 10 0 GGAEMO C[C@H](CCN1CC[NH+](C)CC1)NC(=O)N[C@H]1CCCc2sc(Cl)cc21 ZINC000293596972 565175990 /nfs/dbraw/zinc/17/59/90/565175990.db2.gz ZLZRPRDKQMSRKK-HIFRSBDPSA-N 1 1 384.977 3.104 10 0 GGAEMO C[N@@H+]1CC[C@@H](NC(=O)c2ccncc2Br)[C@@H]1c1ccc(F)cc1 ZINC000371075769 565176354 /nfs/dbraw/zinc/17/63/54/565176354.db2.gz NOMXBSZSZUIFOD-CVEARBPZSA-N 1 1 378.245 3.158 10 0 GGAEMO C[N@H+]1CC[C@@H](NC(=O)c2ccncc2Br)[C@@H]1c1ccc(F)cc1 ZINC000371075769 565176357 /nfs/dbraw/zinc/17/63/57/565176357.db2.gz NOMXBSZSZUIFOD-CVEARBPZSA-N 1 1 378.245 3.158 10 0 GGAEMO Cc1cc(C(=O)N[C@@H]2CCc3nc[nH]c3C2)c2cc(Br)ccc2n1 ZINC000371307234 565185613 /nfs/dbraw/zinc/18/56/13/565185613.db2.gz CDXNCFOARFDBLN-GFCCVEGCSA-N 1 1 385.265 3.316 10 0 GGAEMO C[C@](O)(C[N@H+]1CCC[C@@H](c2ncc[nH]2)C1)c1ccc(Br)cc1F ZINC000293836402 565185858 /nfs/dbraw/zinc/18/58/58/565185858.db2.gz QECSLLIXUWWOFC-PXAZEXFGSA-N 1 1 382.277 3.398 10 0 GGAEMO CN1C[C@@H]([NH2+][C@@H](c2ccc(Br)o2)c2ccc(F)cc2)CCC1=O ZINC000293855133 565186886 /nfs/dbraw/zinc/18/68/86/565186886.db2.gz UIHYZMVNARZNBW-SUMWQHHRSA-N 1 1 381.245 3.481 10 0 GGAEMO CN1C[C@H]([NH2+][C@H](c2ccc(Br)o2)c2ccc(F)cc2)CCC1=O ZINC000293855089 565186969 /nfs/dbraw/zinc/18/69/69/565186969.db2.gz UIHYZMVNARZNBW-DYVFJYSZSA-N 1 1 381.245 3.481 10 0 GGAEMO CCC1(CC)C[N@H+](C[C@H](O)Cc2ccc(C(F)(F)F)cc2)CC[S@@]1=O ZINC000185234655 565188050 /nfs/dbraw/zinc/18/80/50/565188050.db2.gz ZLNCHUNOOFWJRO-CPJLOUKISA-N 1 1 377.472 3.232 10 0 GGAEMO CCC1(CC)C[N@@H+](C[C@H](O)Cc2ccc(C(F)(F)F)cc2)CC[S@@]1=O ZINC000185234655 565188053 /nfs/dbraw/zinc/18/80/53/565188053.db2.gz ZLNCHUNOOFWJRO-CPJLOUKISA-N 1 1 377.472 3.232 10 0 GGAEMO Cc1[nH+]ccn1CCCN(C)C(=O)NCCc1ccccc1Br ZINC000269457504 565190597 /nfs/dbraw/zinc/19/05/97/565190597.db2.gz GHJRJEIGZANCAL-UHFFFAOYSA-N 1 1 379.302 3.228 10 0 GGAEMO CCn1cnnc1[C@@H]1CCC[N@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000159129353 565195646 /nfs/dbraw/zinc/19/56/46/565195646.db2.gz PTFFTVYYYKFGTQ-GFCCVEGCSA-N 1 1 389.301 3.316 10 0 GGAEMO CCn1cnnc1[C@@H]1CCC[N@@H+](Cc2nc3cc(Br)ccc3[nH]2)C1 ZINC000159129353 565195651 /nfs/dbraw/zinc/19/56/51/565195651.db2.gz PTFFTVYYYKFGTQ-GFCCVEGCSA-N 1 1 389.301 3.316 10 0 GGAEMO CCOC(=O)c1sc(NC(=O)C[N@H+](CC)CCc2nccs2)cc1C ZINC000159275611 565200281 /nfs/dbraw/zinc/20/02/81/565200281.db2.gz JKKCFMQGTZIBGB-UHFFFAOYSA-N 1 1 381.523 3.193 10 0 GGAEMO CCOC(=O)c1sc(NC(=O)C[N@@H+](CC)CCc2nccs2)cc1C ZINC000159275611 565200283 /nfs/dbraw/zinc/20/02/83/565200283.db2.gz JKKCFMQGTZIBGB-UHFFFAOYSA-N 1 1 381.523 3.193 10 0 GGAEMO CC[N@@H+](CCc1nccs1)C[C@H](O)COc1ccc(Br)cc1 ZINC000159307060 565201457 /nfs/dbraw/zinc/20/14/57/565201457.db2.gz RDMONVNRHZPWJY-AWEZNQCLSA-N 1 1 385.327 3.210 10 0 GGAEMO CCOCC[N@@H+]1CCN(C(=O)c2csc(Br)c2C)C[C@H]1C ZINC000185450222 565203305 /nfs/dbraw/zinc/20/33/05/565203305.db2.gz GTKDWCJNWXMFIO-LLVKDONJSA-N 1 1 375.332 3.002 10 0 GGAEMO CCOCC[N@H+]1CCN(C(=O)c2csc(Br)c2C)C[C@H]1C ZINC000185450222 565203310 /nfs/dbraw/zinc/20/33/10/565203310.db2.gz GTKDWCJNWXMFIO-LLVKDONJSA-N 1 1 375.332 3.002 10 0 GGAEMO C[NH+]1CCC([C@H]2CCN(C(=O)c3[nH]nc4ccc(Br)cc43)C2)CC1 ZINC000270256980 565213387 /nfs/dbraw/zinc/21/33/87/565213387.db2.gz RAQMZOUXEZLDHP-ZDUSSCGKSA-N 1 1 391.313 3.129 10 0 GGAEMO C[NH+]1CCC([C@@H]2CCN(C(=O)c3[nH]nc4ccc(Br)cc43)C2)CC1 ZINC000270256974 565213774 /nfs/dbraw/zinc/21/37/74/565213774.db2.gz RAQMZOUXEZLDHP-CYBMUJFWSA-N 1 1 391.313 3.129 10 0 GGAEMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000371911880 565215881 /nfs/dbraw/zinc/21/58/81/565215881.db2.gz PXMIXERIZBDMGU-UHOFOFEASA-N 1 1 396.329 3.254 10 0 GGAEMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000371911878 565215989 /nfs/dbraw/zinc/21/59/89/565215989.db2.gz PXMIXERIZBDMGU-DAXOMENPSA-N 1 1 396.329 3.254 10 0 GGAEMO NC(=O)c1ccc(C[NH2+][C@H](c2ccc(Br)cc2)c2cncnc2)cc1 ZINC000186077281 565238631 /nfs/dbraw/zinc/23/86/31/565238631.db2.gz GJEFARMBIGKKFQ-GOSISDBHSA-N 1 1 397.276 3.217 10 0 GGAEMO C[NH+](C)CC(=O)Nc1ccc(NC(=O)Cc2sccc2Br)cc1 ZINC000295013836 565240663 /nfs/dbraw/zinc/24/06/63/565240663.db2.gz CXOVRGUKJVADKK-UHFFFAOYSA-N 1 1 396.310 3.192 10 0 GGAEMO Cn1ccc(C[NH+]2CCC(C(=O)Nc3ccccc3Br)CC2)n1 ZINC000271172369 565240887 /nfs/dbraw/zinc/24/08/87/565240887.db2.gz VQOWNYBOFXLWMH-UHFFFAOYSA-N 1 1 377.286 3.033 10 0 GGAEMO CC[C@@H]([NH2+]Cc1ncc(Br)cc1Br)[C@@H](O)C(F)F ZINC000295081017 565243340 /nfs/dbraw/zinc/24/33/40/565243340.db2.gz QKOSMMRPONSKIE-PSASIEDQSA-N 1 1 388.050 3.101 10 0 GGAEMO CC[N@@H+](CCN[C@@H](c1ccc(Br)cc1)c1cncnc1)C1CC1 ZINC000186162353 565243333 /nfs/dbraw/zinc/24/33/33/565243333.db2.gz JZQROALXJCGHRM-SFHVURJKSA-N 1 1 375.314 3.402 10 0 GGAEMO CC[C@H]([NH2+]Cc1ncc(Br)cc1Br)[C@H](O)C(F)F ZINC000295081027 565244483 /nfs/dbraw/zinc/24/44/83/565244483.db2.gz QKOSMMRPONSKIE-WPRPVWTQSA-N 1 1 388.050 3.101 10 0 GGAEMO C[C@@H](CN[C@H](c1ccc(Br)cc1)c1cncnc1)[N@@H+](C)C1CC1 ZINC000186177671 565244662 /nfs/dbraw/zinc/24/46/62/565244662.db2.gz YLGDXGHEVCIOCK-SCLBCKFNSA-N 1 1 375.314 3.401 10 0 GGAEMO C[N@H+]1CCC[C@@H](CN[C@@H](c2ccc(Br)cc2)c2cncnc2)C1 ZINC000186183981 565245251 /nfs/dbraw/zinc/24/52/51/565245251.db2.gz IRXFUFFGOFDQPR-KSSFIOAISA-N 1 1 375.314 3.260 10 0 GGAEMO CN(C[C@@H]1CC[N@@H+](C)C1)C(=O)c1cc(Br)ccc1Br ZINC000160550021 565250424 /nfs/dbraw/zinc/25/04/24/565250424.db2.gz VULBTCHIMXKOPN-SNVBAGLBSA-N 1 1 390.119 3.235 10 0 GGAEMO CN(C(=O)c1c(Cl)cc(F)cc1Cl)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000372907905 565260073 /nfs/dbraw/zinc/26/00/73/565260073.db2.gz BFNSVTYVFJXYFL-CQSZACIVSA-N 1 1 388.314 3.373 10 0 GGAEMO CN(C(=O)c1c(Cl)cc(F)cc1Cl)[C@@H]1CCN(C2CC[NH+](C)CC2)C1 ZINC000372907905 565260076 /nfs/dbraw/zinc/26/00/76/565260076.db2.gz BFNSVTYVFJXYFL-CQSZACIVSA-N 1 1 388.314 3.373 10 0 GGAEMO C[C@@H](CCN1CCN(C)CC1)[NH2+][C@@H]1CCc2c1ccc(F)c2Br ZINC000295423114 565265692 /nfs/dbraw/zinc/26/56/92/565265692.db2.gz OBDGNOHEMCXEBT-SUMWQHHRSA-N 1 1 384.337 3.191 10 0 GGAEMO C[N@H+]1CCC[C@H](NC(=O)Nc2nnc(SCc3ccc(F)cc3)s2)C1 ZINC000617915795 565267604 /nfs/dbraw/zinc/26/76/04/565267604.db2.gz XCRARHCYNPKJNY-ZDUSSCGKSA-N 1 1 381.502 3.185 10 0 GGAEMO C[NH+](C)[C@@H]1CC[C@@H]2[C@H](C1)OCCN2Cc1nc2ccc(Br)cc2[nH]1 ZINC000373451774 565285984 /nfs/dbraw/zinc/28/59/84/565285984.db2.gz HPJUXBNRQZVQNY-XYPHTWIQSA-N 1 1 393.329 3.009 10 0 GGAEMO O[C@@H](COc1c(Cl)cccc1Cl)C[N@H+]1CCSC2(CCOCC2)C1 ZINC000186848899 565290084 /nfs/dbraw/zinc/29/00/84/565290084.db2.gz NGXBHGIFNNUICJ-CYBMUJFWSA-N 1 1 392.348 3.331 10 0 GGAEMO COc1c(Br)cccc1C[N@@H+]1CCCC[C@H]1CN1CCOCC1 ZINC000186931745 565296172 /nfs/dbraw/zinc/29/61/72/565296172.db2.gz HHASEGHDAUNAPY-INIZCTEOSA-N 1 1 383.330 3.144 10 0 GGAEMO COc1c(Br)cccc1C[N@H+]1CCCC[C@H]1CN1CCOCC1 ZINC000186931745 565296177 /nfs/dbraw/zinc/29/61/77/565296177.db2.gz HHASEGHDAUNAPY-INIZCTEOSA-N 1 1 383.330 3.144 10 0 GGAEMO COc1c(Br)cccc1CN1CCCC[C@H]1C[NH+]1CCOCC1 ZINC000186931745 565296181 /nfs/dbraw/zinc/29/61/81/565296181.db2.gz HHASEGHDAUNAPY-INIZCTEOSA-N 1 1 383.330 3.144 10 0 GGAEMO COc1c(Br)cccc1C[N@@H+]1CCCN(c2ccc(C)nn2)CC1 ZINC000186939483 565296551 /nfs/dbraw/zinc/29/65/51/565296551.db2.gz VLHFKRFTFNREKA-UHFFFAOYSA-N 1 1 391.313 3.268 10 0 GGAEMO COc1c(Br)cccc1C[N@H+]1CCCN(c2ccc(C)nn2)CC1 ZINC000186939483 565296554 /nfs/dbraw/zinc/29/65/54/565296554.db2.gz VLHFKRFTFNREKA-UHFFFAOYSA-N 1 1 391.313 3.268 10 0 GGAEMO COc1c(Br)cccc1C[NH+]1CCC(N(C)c2cccnn2)CC1 ZINC000186939937 565296718 /nfs/dbraw/zinc/29/67/18/565296718.db2.gz UPAUEGWPEHJLPX-UHFFFAOYSA-N 1 1 391.313 3.349 10 0 GGAEMO COc1c(Br)cccc1CN1CCN(C[C@@H]2CCCC[N@H+]2C)CC1 ZINC000186939133 565296897 /nfs/dbraw/zinc/29/68/97/565296897.db2.gz HDHRPIOHSXZCQL-KRWDZBQOSA-N 1 1 396.373 3.060 10 0 GGAEMO NC(=O)C[C@H]([NH2+]Cc1nc2ccc(Br)cc2[nH]1)C1CCCCC1 ZINC000161924103 565297847 /nfs/dbraw/zinc/29/78/47/565297847.db2.gz MGVNVUFSQUFAAJ-AWEZNQCLSA-N 1 1 379.302 3.239 10 0 GGAEMO CCN1CC[NH+](CCCNC(=O)C[C@H](C)c2ccc(Br)cc2)CC1 ZINC000162068728 565303846 /nfs/dbraw/zinc/30/38/46/565303846.db2.gz XYVJJXXDPYNULY-INIZCTEOSA-N 1 1 396.373 3.087 10 0 GGAEMO Brc1ccc(-c2nnc(C[N@@H+]3CCC[C@@H](c4ccncn4)C3)o2)o1 ZINC000373936014 565310864 /nfs/dbraw/zinc/31/08/64/565310864.db2.gz FLVDCBAFHMSALX-LLVKDONJSA-N 1 1 390.241 3.262 10 0 GGAEMO Brc1ccc(-c2nnc(C[N@H+]3CCC[C@@H](c4ccncn4)C3)o2)o1 ZINC000373936014 565310868 /nfs/dbraw/zinc/31/08/68/565310868.db2.gz FLVDCBAFHMSALX-LLVKDONJSA-N 1 1 390.241 3.262 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2cc(OC)ccc2Br)[C@H](C)C1 ZINC000162348232 565313877 /nfs/dbraw/zinc/31/38/77/565313877.db2.gz PJMFVYVLDBDUGC-CXAGYDPISA-N 1 1 383.330 3.189 10 0 GGAEMO Cn1cc[nH+]c1CC1CCN(C(=O)Cc2ccccc2Br)CC1 ZINC000162364221 565314923 /nfs/dbraw/zinc/31/49/23/565314923.db2.gz OTINMCWMOLZCHI-UHFFFAOYSA-N 1 1 376.298 3.206 10 0 GGAEMO 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C[C@H]([NH2+][C@H](C(N)=O)c1ccc(Br)cc1F)[C@@H]1COc2ccccc21 ZINC000163070550 565336122 /nfs/dbraw/zinc/33/61/22/565336122.db2.gz WJTFHDJZBMVRFN-NCHVAJSOSA-N 1 1 393.256 3.269 10 0 GGAEMO CS(=O)(=O)c1cccc(C[NH2+][C@@H]2CCOc3c(Br)cccc32)c1 ZINC000296802156 565337742 /nfs/dbraw/zinc/33/77/42/565337742.db2.gz MRLULNIOZAUXQP-MRXNPFEDSA-N 1 1 396.306 3.466 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)NC[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000163279918 565340922 /nfs/dbraw/zinc/34/09/22/565340922.db2.gz QNDSUKNBJNVBNV-HNNXBMFYSA-N 1 1 397.357 3.484 10 0 GGAEMO O=C(N[C@@H]1CC[N@H+]2CCC[C@@H]2C1)N[C@@H]1CCOc2c(Br)cccc21 ZINC000374459654 565341342 /nfs/dbraw/zinc/34/13/42/565341342.db2.gz CWAPLPYSMMWZGU-XJKCOSOUSA-N 1 1 394.313 3.199 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)Nc1cc(Br)c(C)cc1C ZINC000187564720 565341701 /nfs/dbraw/zinc/34/17/01/565341701.db2.gz FEZKVHNGKZOSDD-CQSZACIVSA-N 1 1 384.318 3.298 10 0 GGAEMO Cc1cc(C)c(NC(=O)N2C[C@@H](C)[C@@H]([NH+]3CCOCC3)C2)cc1Br ZINC000187568489 565341777 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CCOc1cc(C[N@@H+]2CCC[C@](C)(C(=O)OC)C2)cc(Br)c1O ZINC000414556246 565948598 /nfs/dbraw/zinc/94/85/98/565948598.db2.gz JQWPZKSWOOFAON-KRWDZBQOSA-N 1 1 386.286 3.329 10 0 GGAEMO CCOc1cc(C[N@H+]2CCC[C@](C)(C(=O)OC)C2)cc(Br)c1O ZINC000414556246 565948603 /nfs/dbraw/zinc/94/86/03/565948603.db2.gz JQWPZKSWOOFAON-KRWDZBQOSA-N 1 1 386.286 3.329 10 0 GGAEMO C[N@H+]1CC[C@@H](NS(=O)(=O)Cc2ccc(F)c(Cl)c2)[C@@H]1c1ccccc1 ZINC000178947754 565949056 /nfs/dbraw/zinc/94/90/56/565949056.db2.gz URGDFFSEGCLVJQ-MSOLQXFVSA-N 1 1 382.888 3.344 10 0 GGAEMO COC(=O)[C@H]1CSCC[N@@H+](CC2=Cc3cc(Br)ccc3OC2)C1 ZINC000414570500 565949335 /nfs/dbraw/zinc/94/93/35/565949335.db2.gz ROSXNEAMIJDFEP-CQSZACIVSA-N 1 1 398.322 3.063 10 0 GGAEMO CC(C)[N@H+](CC1=Cc2cc(Br)ccc2OC1)C[C@@H]1CCC(=O)N1 ZINC000414565904 565949411 /nfs/dbraw/zinc/94/94/11/565949411.db2.gz ZNQRCGSWPLTMKO-INIZCTEOSA-N 1 1 379.298 3.214 10 0 GGAEMO CCOc1cc(C[N@H+]2CCSC[C@@H](C(=O)OC)C2)ccc1OC(F)F ZINC000414573568 565949464 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CN(C)C(=O)Sc1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)[C@H](CO)C2)cc1 ZINC000286540571 565965968 /nfs/dbraw/zinc/96/59/68/565965968.db2.gz ODGAAKLAUQXBIT-DZGCQCFKSA-N 1 1 376.444 3.453 10 0 GGAEMO CN(C)C(=O)Sc1ccc(C[N@H+]2CC[C@H](C(F)(F)F)[C@H](CO)C2)cc1 ZINC000286540581 565966083 /nfs/dbraw/zinc/96/60/83/565966083.db2.gz ODGAAKLAUQXBIT-ZFWWWQNUSA-N 1 1 376.444 3.453 10 0 GGAEMO COc1ccc(C[NH+]2CCC(c3nnc4n3CCC4)CC2)cc1Br ZINC000361666926 565971616 /nfs/dbraw/zinc/97/16/16/565971616.db2.gz GIOXENRSJNYEGL-UHFFFAOYSA-N 1 1 391.313 3.375 10 0 GGAEMO O=C(NCc1ccc(Oc2cccc(Cl)c2Cl)cc1)[C@H]1COCC[NH2+]1 ZINC000237871736 565974320 /nfs/dbraw/zinc/97/43/20/565974320.db2.gz DTGCKHSFMDXYRQ-OAHLLOKOSA-N 1 1 381.259 3.390 10 0 GGAEMO CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)COc2ccccc2Br)C1 ZINC000179410002 565978597 /nfs/dbraw/zinc/97/85/97/565978597.db2.gz QFFKQRFTCOFWDF-CQSZACIVSA-N 1 1 392.297 3.451 10 0 GGAEMO CC[C@@H](CO)[NH+]1CCN(C(=O)c2cc(SC)c(Cl)cc2Cl)CC1 ZINC000179406691 565978761 /nfs/dbraw/zinc/97/87/61/565978761.db2.gz XWXXNTJPTRIYDJ-NSHDSACASA-N 1 1 377.337 3.244 10 0 GGAEMO Brc1ccc(-n2cc(C[N@H+]3CCC[C@H](n4cncn4)C3)cn2)cc1 ZINC000179466880 565981850 /nfs/dbraw/zinc/98/18/50/565981850.db2.gz UFPGDNIEFCOQKA-KRWDZBQOSA-N 1 1 387.285 3.063 10 0 GGAEMO Cc1nc(CN2CCC[N@H+](Cc3ccc(C)c(Br)c3)CC2)no1 ZINC000179488501 565984098 /nfs/dbraw/zinc/98/40/98/565984098.db2.gz SIWYCHBDDFGJMK-UHFFFAOYSA-N 1 1 379.302 3.157 10 0 GGAEMO Cc1nc(CN2CCC[N@@H+](Cc3ccc(C)c(Br)c3)CC2)no1 ZINC000179488501 565984104 /nfs/dbraw/zinc/98/41/04/565984104.db2.gz SIWYCHBDDFGJMK-UHFFFAOYSA-N 1 1 379.302 3.157 10 0 GGAEMO CC[C@H](NC(=O)C(=O)N(C)[C@@H]1CC[N@@H+](CC)C[C@H]1C)c1ccc(Cl)s1 ZINC000286924886 565985738 /nfs/dbraw/zinc/98/57/38/565985738.db2.gz GSLFATYXHJMWRW-HZSPNIEDSA-N 1 1 385.961 3.158 10 0 GGAEMO Brc1cc(C[NH+]2CCC(Cn3cccn3)CC2)cc2c1OCCO2 ZINC000179531723 565986445 /nfs/dbraw/zinc/98/64/45/565986445.db2.gz HAUVUZACXCYJEI-UHFFFAOYSA-N 1 1 392.297 3.329 10 0 GGAEMO C[C@H](Cn1ncc2ccccc2c1=O)[NH2+][C@H](C)c1ncc(Br)s1 ZINC000179517218 565986859 /nfs/dbraw/zinc/98/68/59/565986859.db2.gz UPKZGSLRPLZNFX-GHMZBOCLSA-N 1 1 393.310 3.355 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)[C@H](C)NC(=O)c1cccc(Cl)c1Cl ZINC000245424447 565989306 /nfs/dbraw/zinc/98/93/06/565989306.db2.gz CMUAQFAHTHDDQV-QWHCGFSZSA-N 1 1 386.323 3.054 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)CSCC(=O)c2ccc(Cl)cc2)[C@@H](C)C1 ZINC000245415801 565989369 /nfs/dbraw/zinc/98/93/69/565989369.db2.gz GYZMJNPDEFOWMX-WMLDXEAASA-N 1 1 382.957 3.445 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)Cc2cc3c(cc2Br)OCCO3)[C@@H](C)C1 ZINC000245438013 565990704 /nfs/dbraw/zinc/99/07/04/565990704.db2.gz RYIKSJHQBNTAKC-XJKSGUPXSA-N 1 1 383.330 3.382 10 0 GGAEMO CCc1nn(C)c(Cl)c1C(=O)N[C@H]1CC[N@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000245579804 565997047 /nfs/dbraw/zinc/99/70/47/565997047.db2.gz IOFPOFQXBXSAAY-HOCLYGCPSA-N 1 1 381.307 3.465 10 0 GGAEMO CCc1nn(C)c(Cl)c1C(=O)N[C@H]1CC[N@@H+](C)[C@H]1c1ccc(Cl)cc1 ZINC000245579804 565997053 /nfs/dbraw/zinc/99/70/53/565997053.db2.gz IOFPOFQXBXSAAY-HOCLYGCPSA-N 1 1 381.307 3.465 10 0 GGAEMO C[N@H+]1CC[C@@H](NS(=O)(=O)Cc2cc(Cl)ccc2F)[C@H]1c1ccccc1 ZINC000245620644 565998567 /nfs/dbraw/zinc/99/85/67/565998567.db2.gz FALMTGYZMVZRKR-QZTJIDSGSA-N 1 1 382.888 3.344 10 0 GGAEMO C[N@@H+]1CC[C@@H](NS(=O)(=O)c2ccccc2Br)[C@H]1c1ccccc1 ZINC000245622432 565999235 /nfs/dbraw/zinc/99/92/35/565999235.db2.gz FNJGAJMIUWIPEU-NVXWUHKLSA-N 1 1 395.322 3.173 10 0 GGAEMO C[N@H+]1CC[C@@H](NS(=O)(=O)c2ccccc2Br)[C@H]1c1ccccc1 ZINC000245622432 565999240 /nfs/dbraw/zinc/99/92/40/565999240.db2.gz FNJGAJMIUWIPEU-NVXWUHKLSA-N 1 1 395.322 3.173 10 0 GGAEMO C[N@H+]1CC[C@@H](CNC(=O)NCc2cscn2)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245667293 566000001 /nfs/dbraw/zinc/00/00/01/566000001.db2.gz HGTOPAAJZIARNK-BLLLJJGKSA-N 1 1 382.892 3.428 10 0 GGAEMO C[N@H+]1CC[C@H](CNC(=O)COCC(F)(F)F)[C@H]1c1ccc(Cl)c(F)c1 ZINC000245642254 566000059 /nfs/dbraw/zinc/00/00/59/566000059.db2.gz AOQFVHKUASXWKO-IAQYHMDHSA-N 1 1 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O=C(CCOc1ccc(Cl)c(Cl)c1)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000261752459 566132413 /nfs/dbraw/zinc/13/24/13/566132413.db2.gz NLHNCFKWIZSZOO-KRWDZBQOSA-N 1 1 380.275 3.330 10 0 GGAEMO Cn1cc([C@@H]2C[NH2+]CCN2C(=O)CCCSc2ccc(Cl)cc2)cn1 ZINC000181344518 566134212 /nfs/dbraw/zinc/13/42/12/566134212.db2.gz VYOMQUNLQSXHJD-KRWDZBQOSA-N 1 1 378.929 3.119 10 0 GGAEMO Cn1ccnc1[C@@H]1C[NH2+]CCN1C(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000261803291 566135466 /nfs/dbraw/zinc/13/54/66/566135466.db2.gz VXWXLWCXSYDTIT-XEZPLFJOSA-N 1 1 379.291 3.004 10 0 GGAEMO Cc1nn2c(nc(C)c2C[NH2+][C@@](C)(CO)c2ccc(Br)cc2)s1 ZINC000289774584 566138642 /nfs/dbraw/zinc/13/86/42/566138642.db2.gz RJVLAIQJPRAION-INIZCTEOSA-N 1 1 395.326 3.167 10 0 GGAEMO C[C@@H](CCc1ccc(Br)cc1)NC(=O)N1CC[NH2+]C[C@@](C)(F)C1 ZINC000417236438 566139096 /nfs/dbraw/zinc/13/90/96/566139096.db2.gz UFRCYBLRIZFPEK-SUMWQHHRSA-N 1 1 386.309 3.113 10 0 GGAEMO C[C@@H]1CN(C(=O)Nc2cc(Cl)cc(Br)c2)[C@@H](C)C[N@@H+]1CCO ZINC000417241574 566140296 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CS(=O)(=O)CC[C@H]1CCCC[N@H+]1Cc1ccccc1OCC(F)(F)F ZINC000366413997 566150711 /nfs/dbraw/zinc/15/07/11/566150711.db2.gz IIAMDRQATZRTSD-OAHLLOKOSA-N 1 1 379.444 3.417 10 0 GGAEMO COCCN1CC[N@@H+](CCCc2ccc(Br)cc2OC)C[C@@H]1C ZINC000181817747 566166875 /nfs/dbraw/zinc/16/68/75/566166875.db2.gz JTHWHXMICGTCKC-HNNXBMFYSA-N 1 1 385.346 3.043 10 0 GGAEMO COCC[N@@H+]1CCN(CCCc2ccc(Br)cc2OC)C[C@@H]1C ZINC000181817747 566166880 /nfs/dbraw/zinc/16/68/80/566166880.db2.gz JTHWHXMICGTCKC-HNNXBMFYSA-N 1 1 385.346 3.043 10 0 GGAEMO COCC[N@H+]1CCN(CCCc2ccc(Br)cc2OC)C[C@@H]1C ZINC000181817747 566166886 /nfs/dbraw/zinc/16/68/86/566166886.db2.gz JTHWHXMICGTCKC-HNNXBMFYSA-N 1 1 385.346 3.043 10 0 GGAEMO C[C@@H](CO)[C@@H](C)NC(=O)NC1CC[NH+](Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000181817055 566167685 /nfs/dbraw/zinc/16/76/85/566167685.db2.gz YKGNGGIAKZARJT-QWHCGFSZSA-N 1 1 388.339 3.274 10 0 GGAEMO CC(C)(CNC(=O)N1CC[NH2+]C[C@](C)(F)C1)c1ccccc1Br ZINC000417917752 566181823 /nfs/dbraw/zinc/18/18/23/566181823.db2.gz 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ZINC000581266685 566762419 /nfs/dbraw/zinc/76/24/19/566762419.db2.gz GKMWNJGVEUKHRA-HOTGVXAUSA-N 1 1 390.281 3.033 10 0 GGAEMO O=S(=O)(C[C@H]1CCCC1(F)F)NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000451136534 566764134 /nfs/dbraw/zinc/76/41/34/566764134.db2.gz QOTQSIUXFSBYTL-LSDHHAIUSA-N 1 1 392.537 3.315 10 0 GGAEMO CN(Cc1ccc(Br)c(F)c1)[C@@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000677801479 566764320 /nfs/dbraw/zinc/76/43/20/566764320.db2.gz SKWKLLVTMSILCB-MRXNPFEDSA-N 1 1 384.337 3.189 10 0 GGAEMO O=C(c1cc[nH]c(=O)c1Br)N1CCC[N@@H+](CC2CCCCC2)CC1 ZINC000469133589 566764243 /nfs/dbraw/zinc/76/42/43/566764243.db2.gz YQCVKQLCXPJJFH-UHFFFAOYSA-N 1 1 396.329 3.278 10 0 GGAEMO O=S(=O)(C[C@@H]1CCCC1(F)F)NC[C@H]1CCC[N@@H+](Cc2cccs2)C1 ZINC000451136531 566764303 /nfs/dbraw/zinc/76/43/03/566764303.db2.gz QOTQSIUXFSBYTL-CABCVRRESA-N 1 1 392.537 3.315 10 0 GGAEMO CN(Cc1ccc(Br)c(F)c1)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000677801479 566764329 /nfs/dbraw/zinc/76/43/29/566764329.db2.gz SKWKLLVTMSILCB-MRXNPFEDSA-N 1 1 384.337 3.189 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)c1oc2ccccc2c1Br ZINC000630932396 566764973 /nfs/dbraw/zinc/76/49/73/566764973.db2.gz JJUBCAGKVDLRAC-LBPRGKRZSA-N 1 1 381.270 3.036 10 0 GGAEMO C[C@H](NC(=O)C[NH2+][C@H](CO)c1cccc(Br)c1)c1ccc(F)cc1 ZINC000541985474 566765370 /nfs/dbraw/zinc/76/53/70/566765370.db2.gz YSIZGNSXQVNUIO-YVEFUNNKSA-N 1 1 395.272 3.089 10 0 GGAEMO C[C@@H](NC(=O)C[NH2+][C@H](CO)c1cccc(Br)c1)c1ccc(F)cc1 ZINC000541985473 566765824 /nfs/dbraw/zinc/76/58/24/566765824.db2.gz YSIZGNSXQVNUIO-SJKOYZFVSA-N 1 1 395.272 3.089 10 0 GGAEMO Cc1cccc(CNC(=O)N2CC[NH2+]C[C@@H]2c2cccnc2)c1Br ZINC000581300005 566766035 /nfs/dbraw/zinc/76/60/35/566766035.db2.gz CISJKQQTSDNTSA-MRXNPFEDSA-N 1 1 389.297 3.009 10 0 GGAEMO Cc1nc2sccn2c(=O)c1CC[N@H+]1CCc2c(Cl)cc(F)cc2C1 ZINC000451161289 566767667 /nfs/dbraw/zinc/76/76/67/566767667.db2.gz JOBKCCJCYSHSKK-UHFFFAOYSA-N 1 1 377.872 3.458 10 0 GGAEMO C[N@H+]1CCC[C@H](NC(=O)NCc2ccc(Br)cc2C(F)(F)F)C1 ZINC000677859186 566767934 /nfs/dbraw/zinc/76/79/34/566767934.db2.gz SARISNVLVDMNOS-LBPRGKRZSA-N 1 1 394.235 3.361 10 0 GGAEMO CN(C(=O)CSCc1ccc(Br)cc1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000609508998 566768640 /nfs/dbraw/zinc/76/86/40/566768640.db2.gz DGCZBCJXCIKBJE-INIZCTEOSA-N 1 1 383.355 3.377 10 0 GGAEMO O=C(C[N@H+]1CCC[C@@H]1c1ccccc1Br)N1CCOC[C@H]1C1CC1 ZINC000677984812 566773278 /nfs/dbraw/zinc/77/32/78/566773278.db2.gz QPVWHFPWXGITBT-MSOLQXFVSA-N 1 1 393.325 3.223 10 0 GGAEMO O=C(C[N@@H+]1CCC[C@@H]1c1ccccc1Br)N1CCOC[C@H]1C1CC1 ZINC000677984812 566773285 /nfs/dbraw/zinc/77/32/85/566773285.db2.gz QPVWHFPWXGITBT-MSOLQXFVSA-N 1 1 393.325 3.223 10 0 GGAEMO Cc1noc(C[N@H+]2CC[C@@H](Cc3cccc(I)c3)C2)n1 ZINC000451185009 566773624 /nfs/dbraw/zinc/77/36/24/566773624.db2.gz BVWTZLYPJMDRLF-ZDUSSCGKSA-N 1 1 383.233 3.047 10 0 GGAEMO Cc1cc(C[N@H+]2CC[C@H](Cc3cccc(I)c3)C2)ncn1 ZINC000451187660 566773662 /nfs/dbraw/zinc/77/36/62/566773662.db2.gz GMROEIAZBAVFMU-OAHLLOKOSA-N 1 1 393.272 3.454 10 0 GGAEMO C[C@H](c1nncn1C)[N@H+]1CC[C@H](Cc2cccc(I)c2)C1 ZINC000451186149 566773691 /nfs/dbraw/zinc/77/36/91/566773691.db2.gz DMHXUTCBTOCTKG-TZMCWYRMSA-N 1 1 396.276 3.045 10 0 GGAEMO Cc1ccnc(C[N@H+]2CC[C@H](Cc3cccc(I)c3)C2)n1 ZINC000451190750 566773793 /nfs/dbraw/zinc/77/37/93/566773793.db2.gz LXYQVYMFOFBXHX-OAHLLOKOSA-N 1 1 393.272 3.454 10 0 GGAEMO C[NH+]1CCN(CCCCNc2ncc(Br)cc2C(F)(F)F)CC1 ZINC000631058388 566774325 /nfs/dbraw/zinc/77/43/25/566774325.db2.gz DUTPFARABKYDBZ-UHFFFAOYSA-N 1 1 395.267 3.302 10 0 GGAEMO O=C(CC[NH2+]Cc1ncc(Br)cc1Cl)NCc1ccccc1 ZINC000631056877 566774487 /nfs/dbraw/zinc/77/44/87/566774487.db2.gz OLFVXYKVOUFBRK-UHFFFAOYSA-N 1 1 382.689 3.294 10 0 GGAEMO Brc1ccc(C2([NH2+]Cc3cn(C[C@H]4CCOC4)nn3)CCC2)cc1 ZINC000631059531 566775714 /nfs/dbraw/zinc/77/57/14/566775714.db2.gz NSPNXFNYQNWMCN-CQSZACIVSA-N 1 1 391.313 3.246 10 0 GGAEMO Nc1cc(C[N@H+]2CC[C@H](Cc3cccc(I)c3)C2)ccn1 ZINC000451195691 566775610 /nfs/dbraw/zinc/77/56/10/566775610.db2.gz USWBXXDFMREYCC-OAHLLOKOSA-N 1 1 393.272 3.163 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1C[C@@H]1CCCN(S(=O)(=O)C[C@@H]2CCCC2(F)F)C1 ZINC000451196993 566775707 /nfs/dbraw/zinc/77/57/07/566775707.db2.gz XOARUZUWWIKBKY-IKGGRYGDSA-N 1 1 378.529 3.338 10 0 GGAEMO NS(=O)(=O)c1cc(C[NH2+]Cc2ccccc2OC2CCC2)ccc1Cl ZINC000631075339 566775847 /nfs/dbraw/zinc/77/58/47/566775847.db2.gz QDMWCHKWJNYXOI-UHFFFAOYSA-N 1 1 380.897 3.209 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CNC(=O)N[C@@H](C)c1ccc(Br)cc1OC ZINC000469265196 566776241 /nfs/dbraw/zinc/77/62/41/566776241.db2.gz CPFMDFRUDALWQV-GXTWGEPZSA-N 1 1 384.318 3.302 10 0 GGAEMO Brc1ccc(C2([NH2+]Cc3cn(C[C@@H]4CCOC4)nn3)CCC2)cc1 ZINC000631059530 566776282 /nfs/dbraw/zinc/77/62/82/566776282.db2.gz NSPNXFNYQNWMCN-AWEZNQCLSA-N 1 1 391.313 3.246 10 0 GGAEMO COc1cccc(-c2nc(CSC[C@@H]3C[N@H+](C)CCO3)cs2)c1OC ZINC000581428870 566777108 /nfs/dbraw/zinc/77/71/08/566777108.db2.gz IVMATWAGFRXJAK-AWEZNQCLSA-N 1 1 380.535 3.391 10 0 GGAEMO COc1cccc(-c2nc(CSC[C@@H]3C[N@@H+](C)CCO3)cs2)c1OC ZINC000581428870 566777115 /nfs/dbraw/zinc/77/71/15/566777115.db2.gz IVMATWAGFRXJAK-AWEZNQCLSA-N 1 1 380.535 3.391 10 0 GGAEMO O=C(C1CCCC1)N1CC[C@H]([NH2+]Cc2ncc(Br)cc2Cl)C1 ZINC000631090751 566778575 /nfs/dbraw/zinc/77/85/75/566778575.db2.gz SNWNPMNZABQDOX-ZDUSSCGKSA-N 1 1 386.721 3.378 10 0 GGAEMO C[C@@H](C(=O)N(CCO)Cc1cc(Br)cs1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000427555810 566778842 /nfs/dbraw/zinc/77/88/42/566778842.db2.gz LZNYFRRZDHZVNL-XQQFMLRXSA-N 1 1 389.359 3.093 10 0 GGAEMO O=S(=O)(C[C@H](O)C[NH2+]Cc1oc2ccccc2c1Cl)c1cccs1 ZINC000631098704 566780043 /nfs/dbraw/zinc/78/00/43/566780043.db2.gz CAFAGZCHWQYAGH-LLVKDONJSA-N 1 1 385.894 3.072 10 0 GGAEMO CC[C@H]([NH2+]Cc1cn(C[C@H]2CCOC2)nn1)c1cc(F)cc(Br)c1 ZINC000631114639 566780264 /nfs/dbraw/zinc/78/02/64/566780264.db2.gz GTHSJZYYCAAMAB-PXAZEXFGSA-N 1 1 397.292 3.457 10 0 GGAEMO CCO[C@@H]1C[C@H]([NH2+]Cc2ncc(Br)cc2Cl)[C@@]12CCCO2 ZINC000631113216 566780765 /nfs/dbraw/zinc/78/07/65/566780765.db2.gz ULHUYKGRQRWCDS-ZNMIVQPWSA-N 1 1 375.694 3.314 10 0 GGAEMO C[N@H+]1CCC[C@H](CCNC(=O)N[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000655143107 566780808 /nfs/dbraw/zinc/78/08/08/566780808.db2.gz AEFKJYTVXQULIH-CJNGLKHVSA-N 1 1 396.329 3.304 10 0 GGAEMO CO[C@@H](C(=O)N1CC[NH2+][C@@H](c2ccccc2)C1)c1ccccc1Br ZINC000655139983 566780831 /nfs/dbraw/zinc/78/08/31/566780831.db2.gz ZTVIXGFMNJRIQH-QZTJIDSGSA-N 1 1 389.293 3.310 10 0 GGAEMO CO[C@@H](C(=O)N1CC[NH2+][C@H](c2ccccc2)C1)c1ccccc1Br ZINC000655139985 566780894 /nfs/dbraw/zinc/78/08/94/566780894.db2.gz ZTVIXGFMNJRIQH-ZWKOTPCHSA-N 1 1 389.293 3.310 10 0 GGAEMO C[N@H+]1CCC[C@H](CNS(=O)(=O)CC2CC(F)(F)C2)[C@H]1c1cccs1 ZINC000451243503 566781292 /nfs/dbraw/zinc/78/12/92/566781292.db2.gz PLDSDHWYJKDIHR-HIFRSBDPSA-N 1 1 378.510 3.096 10 0 GGAEMO O=C(N[C@H]1CCCC[C@@H]1[NH+]1CCOCC1)N1CCc2sc(Cl)cc2C1 ZINC000516764818 566782406 /nfs/dbraw/zinc/78/24/06/566782406.db2.gz NNHWWYNTKOEWIX-GJZGRUSLSA-N 1 1 383.945 3.113 10 0 GGAEMO C[C@@H]1CC[N@H+](CC(=O)Nc2cnc(-c3ccc(Br)s3)nc2)C1 ZINC000655159466 566782397 /nfs/dbraw/zinc/78/23/97/566782397.db2.gz OKIADVQORWIURO-SNVBAGLBSA-N 1 1 381.299 3.248 10 0 GGAEMO C[C@@H]1CC[N@@H+](CC(=O)Nc2cnc(-c3ccc(Br)s3)nc2)C1 ZINC000655159466 566782400 /nfs/dbraw/zinc/78/24/00/566782400.db2.gz OKIADVQORWIURO-SNVBAGLBSA-N 1 1 381.299 3.248 10 0 GGAEMO CC[C@H]1[C@@H](CO)CC[N@@H+]1Cc1nc(Cc2cccc(Br)c2)no1 ZINC000451261917 566785298 /nfs/dbraw/zinc/78/52/98/566785298.db2.gz WWMUKGPZOVBFGZ-HIFRSBDPSA-N 1 1 380.286 3.016 10 0 GGAEMO CC[C@H]1[C@@H](CO)CC[N@H+]1Cc1nc(Cc2cccc(Br)c2)no1 ZINC000451261917 566785307 /nfs/dbraw/zinc/78/53/07/566785307.db2.gz WWMUKGPZOVBFGZ-HIFRSBDPSA-N 1 1 380.286 3.016 10 0 GGAEMO CCO[C@@H]1C[C@@H]([NH2+]Cc2ncc(Br)cc2Cl)[C@@H]1n1cccn1 ZINC000631145611 566785453 /nfs/dbraw/zinc/78/54/53/566785453.db2.gz NNYVCUQLWDUNQK-YUELXQCFSA-N 1 1 385.693 3.202 10 0 GGAEMO COc1cc(Br)ccc1OC[C@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000489418128 566786356 /nfs/dbraw/zinc/78/63/56/566786356.db2.gz IDKJDZSFLOLUGR-QGZVFWFLSA-N 1 1 392.293 3.256 10 0 GGAEMO COc1cc(Br)ccc1OC[C@@H](O)C[N@H+]1CCc2ccccc2C1 ZINC000489418127 566786594 /nfs/dbraw/zinc/78/65/94/566786594.db2.gz IDKJDZSFLOLUGR-KRWDZBQOSA-N 1 1 392.293 3.256 10 0 GGAEMO O=C(C[NH+]1CCC(c2cccnc2)CC1)Nc1ccc(Br)cn1 ZINC000678167794 566787444 /nfs/dbraw/zinc/78/74/44/566787444.db2.gz NKUAXICGGAVRFX-UHFFFAOYSA-N 1 1 375.270 3.057 10 0 GGAEMO COc1cc(C[NH2+]Cc2ccnn2CC2CCC2)c(Br)cc1O ZINC000631166915 566787781 /nfs/dbraw/zinc/78/77/81/566787781.db2.gz NOYQMUKJHHTNMQ-UHFFFAOYSA-N 1 1 380.286 3.450 10 0 GGAEMO C[N@H+]1CCC[C@H]1C(=O)NCCOc1ccc(Br)cc1C(F)(F)F ZINC000489454703 566788263 /nfs/dbraw/zinc/78/82/63/566788263.db2.gz FRODPLKCRQWCFT-LBPRGKRZSA-N 1 1 395.219 3.057 10 0 GGAEMO Cc1ccc(S(=O)(=O)NC[C@@H](c2cccc(C(F)(F)F)c2)[NH+](C)C)o1 ZINC000469414301 566788724 /nfs/dbraw/zinc/78/87/24/566788724.db2.gz PPOCSNUPFNVPBR-AWEZNQCLSA-N 1 1 376.400 3.188 10 0 GGAEMO O=C(NC[C@H]1CCC[N@H+]1CC1CCCCC1)c1cc[nH]c(=O)c1Br ZINC000469412112 566788907 /nfs/dbraw/zinc/78/89/07/566788907.db2.gz 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CN1CC[NH+](Cc2cccc(NCc3c(F)cncc3Br)c2)CC1 ZINC000657328272 567046902 /nfs/dbraw/zinc/04/69/02/567046902.db2.gz UXXLREVVFNNBON-UHFFFAOYSA-N 1 1 393.304 3.343 10 0 GGAEMO CCC[NH+]1CCN(C(=O)c2cc(C)n(-c3ccc(Br)cc3)n2)CC1 ZINC000431020096 567046918 /nfs/dbraw/zinc/04/69/18/567046918.db2.gz WMYHXSCSZBRRCX-UHFFFAOYSA-N 1 1 391.313 3.111 10 0 GGAEMO CC[C@H](C)[N@@H+](C)CCNC(=O)c1cc(C)n(-c2ccc(Br)cc2)n1 ZINC000431021755 567047670 /nfs/dbraw/zinc/04/76/70/567047670.db2.gz KWJFZTPYPYIZPA-ZDUSSCGKSA-N 1 1 393.329 3.403 10 0 GGAEMO Cc1cc(Br)ccc1NC(=O)CC[NH2+]Cc1cn(C2CCC2)nn1 ZINC000657342780 567048386 /nfs/dbraw/zinc/04/83/86/567048386.db2.gz SOMBZAGJSKXGLJ-UHFFFAOYSA-N 1 1 392.301 3.192 10 0 GGAEMO Brc1ccc(N2CC[C@@H]([NH2+]Cc3ccnn3-c3ccncc3)C2)cc1 ZINC000657351326 567049007 /nfs/dbraw/zinc/04/90/07/567049007.db2.gz CJVCWBOCMJYFOX-MRXNPFEDSA-N 1 1 398.308 3.398 10 0 GGAEMO Cn1cc(Br)cc1C(=O)N1CC[NH2+]C[C@@H]1c1ccccc1Cl ZINC000521227232 567051002 /nfs/dbraw/zinc/05/10/02/567051002.db2.gz AFGARMNDNQUWBQ-OAHLLOKOSA-N 1 1 382.689 3.228 10 0 GGAEMO CC[N@@H+]1CC[C@@H](CN[C@H](C)c2ccc(F)c(I)c2)C1 ZINC000453057904 567051480 /nfs/dbraw/zinc/05/14/80/567051480.db2.gz FZPIWMSRVFLZTL-NEPJUHHUSA-N 1 1 376.257 3.423 10 0 GGAEMO CC[N@H+]1CC[C@@H](CN[C@H](C)c2ccc(F)c(I)c2)C1 ZINC000453057904 567051483 /nfs/dbraw/zinc/05/14/83/567051483.db2.gz FZPIWMSRVFLZTL-NEPJUHHUSA-N 1 1 376.257 3.423 10 0 GGAEMO CN1CC[C@H]([NH2+]CCCNC(=O)c2cccc(Br)c2)[C@H]2CCC[C@@H]21 ZINC000565263350 567052374 /nfs/dbraw/zinc/05/23/74/567052374.db2.gz WFPHDVLQFMELLJ-SQNIBIBYSA-N 1 1 394.357 3.031 10 0 GGAEMO COc1ccccc1N1CC[C@@H]([NH2+]Cc2c(F)cncc2Br)C1 ZINC000657394884 567053241 /nfs/dbraw/zinc/05/32/41/567053241.db2.gz POHJKUQAXQUUPC-GFCCVEGCSA-N 1 1 380.261 3.360 10 0 GGAEMO COc1ccccc1N1CC[C@H]([NH2+]Cc2c(F)cncc2Br)C1 ZINC000657394885 567053662 /nfs/dbraw/zinc/05/36/62/567053662.db2.gz POHJKUQAXQUUPC-LBPRGKRZSA-N 1 1 380.261 3.360 10 0 GGAEMO COc1c(Br)cccc1C[NH2+]Cc1c(C(F)(F)F)cnn1C ZINC000657391495 567054747 /nfs/dbraw/zinc/05/47/47/567054747.db2.gz LSDLLOMLEVYZOR-UHFFFAOYSA-N 1 1 378.192 3.500 10 0 GGAEMO O=S(=O)(CC[NH2+][C@H](CCO)c1ccc(Cl)c(F)c1)c1ccc(F)cc1 ZINC000634724616 567055215 /nfs/dbraw/zinc/05/52/15/567055215.db2.gz UAUBEQKRAGXJKP-QGZVFWFLSA-N 1 1 389.851 3.105 10 0 GGAEMO O=C([C@@H]1CCc2cc(Br)ccc21)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000565304200 567055518 /nfs/dbraw/zinc/05/55/18/567055518.db2.gz POZQHMMGMHKBOX-MSOLQXFVSA-N 1 1 386.293 3.047 10 0 GGAEMO C[C@H](NC(=O)N1CC[NH2+]C[C@@H]1c1cccnc1)c1ccc(Br)cc1 ZINC000584580606 567055816 /nfs/dbraw/zinc/05/58/16/567055816.db2.gz PNKFMSZZEZGBHD-SUMWQHHRSA-N 1 1 389.297 3.261 10 0 GGAEMO C[C@H](NC(=O)N1CC[NH2+]C[C@H]1c1cccnc1)c1ccc(Br)cc1 ZINC000584580605 567055951 /nfs/dbraw/zinc/05/59/51/567055951.db2.gz PNKFMSZZEZGBHD-GUYCJALGSA-N 1 1 389.297 3.261 10 0 GGAEMO CN([C@H]1CC[N@@H+](C2CC2)C1)S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000521376706 567057533 /nfs/dbraw/zinc/05/75/33/567057533.db2.gz IMBGQQWAUPIAQC-LBPRGKRZSA-N 1 1 382.835 3.216 10 0 GGAEMO CN([C@H]1CC[N@H+](C2CC2)C1)S(=O)(=O)c1ccc(Cl)cc1C(F)(F)F ZINC000521376706 567057539 /nfs/dbraw/zinc/05/75/39/567057539.db2.gz IMBGQQWAUPIAQC-LBPRGKRZSA-N 1 1 382.835 3.216 10 0 GGAEMO Brc1cccc(N2CC[C@@H]([NH2+]Cc3ccnn3-c3ccncc3)C2)c1 ZINC000657451207 567058848 /nfs/dbraw/zinc/05/88/48/567058848.db2.gz KBXHUQCFAIJKFL-MRXNPFEDSA-N 1 1 398.308 3.398 10 0 GGAEMO CC(C)(C)O[C@@H]1C[C@H]([NH2+]Cc2c(F)cncc2Br)[C@H]1n1cccn1 ZINC000657485739 567060122 /nfs/dbraw/zinc/06/01/22/567060122.db2.gz MMMIOTLHYZCDPD-ARFHVFGLSA-N 1 1 397.292 3.467 10 0 GGAEMO Cc1cc(Br)ccc1NC(=O)C[N@@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000495445193 567060926 /nfs/dbraw/zinc/06/09/26/567060926.db2.gz ROFRZBBHVIJILA-ZBFHGGJFSA-N 1 1 383.330 3.425 10 0 GGAEMO Cc1cc(Br)ccc1NC(=O)C[N@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000495445193 567060932 /nfs/dbraw/zinc/06/09/32/567060932.db2.gz ROFRZBBHVIJILA-ZBFHGGJFSA-N 1 1 383.330 3.425 10 0 GGAEMO Cc1cc(Br)ccc1NC(=O)C[N@@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000495445190 567061253 /nfs/dbraw/zinc/06/12/53/567061253.db2.gz ROFRZBBHVIJILA-GDBMZVCRSA-N 1 1 383.330 3.425 10 0 GGAEMO Cc1cc(Br)ccc1NC(=O)C[N@H+]1CC[C@@H](C(C)(C)C)[C@H](O)C1 ZINC000495445190 567061258 /nfs/dbraw/zinc/06/12/58/567061258.db2.gz ROFRZBBHVIJILA-GDBMZVCRSA-N 1 1 383.330 3.425 10 0 GGAEMO CCOC(=O)c1nn(C)cc1C[NH2+]C(C)(C)c1ccc(Br)cc1 ZINC000473117339 567064087 /nfs/dbraw/zinc/06/40/87/567064087.db2.gz BPFYJUNUWVUWEB-UHFFFAOYSA-N 1 1 380.286 3.384 10 0 GGAEMO O=C(C[NH2+][C@@H](CO)c1ccsc1)Nc1ccc(Br)cc1Cl ZINC000473168596 567065011 /nfs/dbraw/zinc/06/50/11/567065011.db2.gz HZZINTBCGLVZNN-ZDUSSCGKSA-N 1 1 389.702 3.426 10 0 GGAEMO Cc1cc(NC(=O)[C@@H](C)[NH2+][C@@H](CO)c2ccsc2)ccc1Br ZINC000473165864 567065404 /nfs/dbraw/zinc/06/54/04/567065404.db2.gz GSOQYVDQZSFMDP-ABAIWWIYSA-N 1 1 383.311 3.469 10 0 GGAEMO C[C@@H]([NH2+][C@H](CO)c1ccsc1)C(=O)N(C)Cc1nc2ccccc2s1 ZINC000473159716 567065588 /nfs/dbraw/zinc/06/55/88/567065588.db2.gz DBZORNIBJDPLKN-IUODEOHRSA-N 1 1 375.519 3.028 10 0 GGAEMO O=C(C[NH2+][C@@H](CO)c1ccsc1)Nc1nc(-c2ccc(F)cc2)cs1 ZINC000473167022 567065839 /nfs/dbraw/zinc/06/58/39/567065839.db2.gz RJFVVDDRFRXASA-AWEZNQCLSA-N 1 1 377.466 3.272 10 0 GGAEMO CCc1c[nH]c(=O)c(C(=O)Nc2ccc(C[NH+](C)C)c(Br)c2)c1 ZINC000613841277 567065989 /nfs/dbraw/zinc/06/59/89/567065989.db2.gz JQPVEEOBNTWJKS-UHFFFAOYSA-N 1 1 378.270 3.426 10 0 GGAEMO COc1cc(CC(=O)Nc2ccc(C[NH+](C)C)c(Br)c2)ccn1 ZINC000613841608 567066209 /nfs/dbraw/zinc/06/62/09/567066209.db2.gz VAQCTRPARHPIHB-UHFFFAOYSA-N 1 1 378.270 3.096 10 0 GGAEMO C[C@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1ccc(F)c(I)c1 ZINC000453248048 567066463 /nfs/dbraw/zinc/06/64/63/567066463.db2.gz ISDJSWCRGPRECL-GXSJLCMTSA-N 1 1 385.224 3.362 10 0 GGAEMO C[C@H](NC(=O)C[NH2+][C@H](CO)c1ccsc1)c1ccc(Br)cc1 ZINC000473175472 567066918 /nfs/dbraw/zinc/06/69/18/567066918.db2.gz HQBIRWSNAFCOTQ-XHDPSFHLSA-N 1 1 383.311 3.011 10 0 GGAEMO O=C(N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1)N1CC[NH+](C2CC2)CC1 ZINC000431214912 567067438 /nfs/dbraw/zinc/06/74/38/567067438.db2.gz YKPJZDRCQGGIAS-HDJSIYSDSA-N 1 1 396.304 3.324 10 0 GGAEMO O=S(=O)(CC[NH2+][C@H](CO)c1ccsc1)c1cc(Cl)ccc1Cl ZINC000473175614 567067666 /nfs/dbraw/zinc/06/76/66/567067666.db2.gz TYEMYDZRNFPGOF-CYBMUJFWSA-N 1 1 380.318 3.152 10 0 GGAEMO FC(F)(F)c1ncc(C[NH2+]Cc2cc(Br)cc3c2OCC3)cn1 ZINC000657549849 567068700 /nfs/dbraw/zinc/06/87/00/567068700.db2.gz KQYXFPLKVDUMQZ-UHFFFAOYSA-N 1 1 388.187 3.483 10 0 GGAEMO O=C(CCOc1cccc(Cl)c1Cl)N1CC[NH2+]C[C@H]1c1ccncc1 ZINC000584774551 567069061 /nfs/dbraw/zinc/06/90/61/567069061.db2.gz JWTVZACZJCZTFF-HNNXBMFYSA-N 1 1 380.275 3.330 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)c1cc(Br)cc2ccccc21 ZINC000521646894 567070330 /nfs/dbraw/zinc/07/03/30/567070330.db2.gz BUJAYOLVGQKINS-INIZCTEOSA-N 1 1 391.309 3.443 10 0 GGAEMO COc1ccc(Br)cc1C[NH2+][C@@H]1Cc2ccccc2N(C)C1=O ZINC000657572540 567071524 /nfs/dbraw/zinc/07/15/24/567071524.db2.gz ZWSUREZVOFCTRA-OAHLLOKOSA-N 1 1 375.266 3.135 10 0 GGAEMO O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ncsc1Br ZINC000565485455 567072553 /nfs/dbraw/zinc/07/25/53/567072553.db2.gz DKGVUVJRPSILKW-ZDUSSCGKSA-N 1 1 380.311 3.158 10 0 GGAEMO COc1ccc(C[NH2+][C@@H]2Cc3ccccc3N(C)C2=O)c(Br)c1 ZINC000657574899 567072650 /nfs/dbraw/zinc/07/26/50/567072650.db2.gz QBFPMGWQOGIBKY-MRXNPFEDSA-N 1 1 375.266 3.135 10 0 GGAEMO CC[N@@H+](CCNC(=O)c1cncc(Br)c1C)CCC(F)(F)F ZINC000613974778 567073948 /nfs/dbraw/zinc/07/39/48/567073948.db2.gz PYKDCOKVLLIOTQ-UHFFFAOYSA-N 1 1 382.224 3.157 10 0 GGAEMO O[C@@H]1CC[N@@H+](Cc2ccc(CNCc3ccc(F)cc3Br)cc2)C1 ZINC000657596987 567074629 /nfs/dbraw/zinc/07/46/29/567074629.db2.gz PZAAUVJUKRJRQK-GOSISDBHSA-N 1 1 393.300 3.445 10 0 GGAEMO Cc1cc(C(=O)N[C@H]2CC[N@@H+](C)[C@@H](C)C2)nn1-c1ccc(Br)cc1 ZINC000431324245 567074757 /nfs/dbraw/zinc/07/47/57/567074757.db2.gz VHHDPVMYIOXUCO-WFASDCNBSA-N 1 1 391.313 3.156 10 0 GGAEMO O[C@@H]1CC[N@H+](Cc2ccc(CNCc3cccc(Br)c3F)cc2)C1 ZINC000657596457 567074780 /nfs/dbraw/zinc/07/47/80/567074780.db2.gz NHQURHJYFDLQAD-QGZVFWFLSA-N 1 1 393.300 3.445 10 0 GGAEMO O[C@@H]1CC[N@@H+](Cc2ccc(CNCc3cccc(Br)c3F)cc2)C1 ZINC000657596457 567074786 /nfs/dbraw/zinc/07/47/86/567074786.db2.gz NHQURHJYFDLQAD-QGZVFWFLSA-N 1 1 393.300 3.445 10 0 GGAEMO CCC[N@@H+](CC)CCNC(=O)c1cc(C)n(-c2ccc(Br)cc2)n1 ZINC000431326008 567075304 /nfs/dbraw/zinc/07/53/04/567075304.db2.gz LJPSBPNUCDWSAZ-UHFFFAOYSA-N 1 1 393.329 3.405 10 0 GGAEMO CC1(C)C[NH+](CC(=O)N(Cc2cccc(Br)c2)C2CCOCC2)C1 ZINC000584848649 567076197 /nfs/dbraw/zinc/07/61/97/567076197.db2.gz CFUOUNRJQXITAR-UHFFFAOYSA-N 1 1 395.341 3.299 10 0 GGAEMO Fc1cncc(Br)c1CNCC1CC[NH+](Cc2ccncc2)CC1 ZINC000657613979 567077339 /nfs/dbraw/zinc/07/73/39/567077339.db2.gz ZTEHODLGOWWUGF-UHFFFAOYSA-N 1 1 393.304 3.380 10 0 GGAEMO CCOc1cc(Br)c(F)cc1NC(=O)N1CC[NH+](C2CC2)CC1 ZINC000584869614 567077854 /nfs/dbraw/zinc/07/78/54/567077854.db2.gz QDQABWDXEDAFKU-UHFFFAOYSA-N 1 1 386.265 3.299 10 0 GGAEMO C[C@@H]1CC[C@H]([NH2+]Cc2cc(Br)ccc2OC(F)F)CS1(=O)=O ZINC000657635302 567078112 /nfs/dbraw/zinc/07/81/12/567078112.db2.gz OYDCSPYAQVGORJ-SKDRFNHKSA-N 1 1 398.269 3.106 10 0 GGAEMO CCCOc1ccc(Br)cc1C[NH2+][C@@H]1CC[C@@H](C)S(=O)(=O)C1 ZINC000657634656 567078315 /nfs/dbraw/zinc/07/83/15/567078315.db2.gz KCWXEQYDDFSBQZ-IUODEOHRSA-N 1 1 390.343 3.293 10 0 GGAEMO C[C@H]1CC[C@H]([NH2+]Cc2cccc(Br)c2OC(F)F)CS1(=O)=O ZINC000657639927 567078687 /nfs/dbraw/zinc/07/86/87/567078687.db2.gz WGZNQAQFIYEJCY-ONGXEEELSA-N 1 1 398.269 3.106 10 0 GGAEMO CCOC(=O)C[N@H+](C[C@@H](O)COc1c(Cl)cccc1Cl)C(C)(C)C ZINC000431382609 567078751 /nfs/dbraw/zinc/07/87/51/567078751.db2.gz MNXIWYXXCZYAJY-GFCCVEGCSA-N 1 1 378.296 3.397 10 0 GGAEMO CCOC(=O)C[N@@H+](C[C@@H](O)COc1c(Cl)cccc1Cl)C(C)(C)C ZINC000431382609 567078754 /nfs/dbraw/zinc/07/87/54/567078754.db2.gz MNXIWYXXCZYAJY-GFCCVEGCSA-N 1 1 378.296 3.397 10 0 GGAEMO C[C@@H]1CC[C@@H]([NH2+]Cc2cc(OC(F)F)ccc2Br)CS1(=O)=O ZINC000657636254 567079062 /nfs/dbraw/zinc/07/90/62/567079062.db2.gz BECRIBJISDZADD-MWLCHTKSSA-N 1 1 398.269 3.106 10 0 GGAEMO C[C@@H]1CC[C@@H]([NH2+]Cc2cccc(Br)c2OC(F)F)CS1(=O)=O ZINC000657639926 567079262 /nfs/dbraw/zinc/07/92/62/567079262.db2.gz WGZNQAQFIYEJCY-MWLCHTKSSA-N 1 1 398.269 3.106 10 0 GGAEMO Cc1ccc(C(=O)N2CCC[N@@H+](C[C@H]3CCCO3)CC2)c(C)c1Br ZINC000682886504 567079397 /nfs/dbraw/zinc/07/93/97/567079397.db2.gz HGSAISDUDKJKQC-MRXNPFEDSA-N 1 1 395.341 3.393 10 0 GGAEMO Cc1ccc(C(=O)N2CCC[N@@H+](C[C@@H]3CCCO3)CC2)c(C)c1Br ZINC000682886503 567079495 /nfs/dbraw/zinc/07/94/95/567079495.db2.gz HGSAISDUDKJKQC-INIZCTEOSA-N 1 1 395.341 3.393 10 0 GGAEMO Cc1c(Br)c2ccccc2n1CC(=O)NC[C@H]1CC[N@H+](C2CC2)C1 ZINC000521778577 567079671 /nfs/dbraw/zinc/07/96/71/567079671.db2.gz ACAZFCRTDKINLA-CQSZACIVSA-N 1 1 390.325 3.313 10 0 GGAEMO C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NCCC[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000496735317 567080331 /nfs/dbraw/zinc/08/03/31/567080331.db2.gz FNXGVIOMCYRFGA-MJBXVCDLSA-N 1 1 389.323 3.376 10 0 GGAEMO Cc1ccc(C(=O)NC[C@H](C(C)C)N2CC[NH+](C)CC2)c(C)c1Br ZINC000682899827 567080973 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C[N@H+]1CCC[C@H]1[C@H]1COCCN1C(=O)c1ccc(Cl)c(Br)c1 ZINC000615269182 567175688 /nfs/dbraw/zinc/17/56/88/567175688.db2.gz KHDRMNGQBWPSGK-LSDHHAIUSA-N 1 1 387.705 3.038 10 0 GGAEMO C[N@H+]1CCC[C@H]1[C@H]1COCCN1C(=O)c1cc(Cl)cc(Br)c1 ZINC000615268229 567175853 /nfs/dbraw/zinc/17/58/53/567175853.db2.gz FVEXHQMMARHFMI-LSDHHAIUSA-N 1 1 387.705 3.038 10 0 GGAEMO Cc1c(C[N@@H+](C)CCC(=O)Nc2ccc(Br)cc2F)cnn1C ZINC000684107567 567179395 /nfs/dbraw/zinc/17/93/95/567179395.db2.gz MPOVXXPBHKDJOY-UHFFFAOYSA-N 1 1 383.265 3.091 10 0 GGAEMO Cc1cc(Br)cc(C)c1NC(=O)CCC[N@H+]1C[C@@H](O)C(C)(C)C1 ZINC000684108245 567179903 /nfs/dbraw/zinc/17/99/03/567179903.db2.gz UIKUWGNNEKXDHX-OAHLLOKOSA-N 1 1 383.330 3.487 10 0 GGAEMO CC[C@@H]1C[N@H+](C)CCN1C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000615379720 567181788 /nfs/dbraw/zinc/18/17/88/567181788.db2.gz DARICDSRDFGVKG-MRXNPFEDSA-N 1 1 380.330 3.216 10 0 GGAEMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000615379720 567181797 /nfs/dbraw/zinc/18/17/97/567181797.db2.gz DARICDSRDFGVKG-MRXNPFEDSA-N 1 1 380.330 3.216 10 0 GGAEMO O=C(CSCc1cc(-c2cccs2)on1)N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC000498519902 567183150 /nfs/dbraw/zinc/18/31/50/567183150.db2.gz XQXZSJZJWNDXJD-ZFWWWQNUSA-N 1 1 377.535 3.379 10 0 GGAEMO C[N@H+]1CCC[C@H](NC(=O)N2CCC[C@@H](Nc3cccc(Br)c3)C2)C1 ZINC000684135013 567183438 /nfs/dbraw/zinc/18/34/38/567183438.db2.gz NDYMKVCBBIURAH-DLBZAZTESA-N 1 1 395.345 3.129 10 0 GGAEMO Cc1cc(CCC(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)ccc1Br ZINC000684180774 567184443 /nfs/dbraw/zinc/18/44/43/567184443.db2.gz BJFGMLSINVJZJL-IRXDYDNUSA-N 1 1 383.305 3.335 10 0 GGAEMO C[C@H](Oc1cccc(Cl)c1Cl)C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000684182650 567185143 /nfs/dbraw/zinc/18/51/43/567185143.db2.gz LGJFTTNVLRRRAX-YUTCNCBUSA-N 1 1 375.271 3.405 10 0 GGAEMO Cc1cc(CCC(=O)N2CC[C@@H]([NH+]3CCC3)[C@H](F)C2)ccc1Br ZINC000684180772 567185156 /nfs/dbraw/zinc/18/51/56/567185156.db2.gz BJFGMLSINVJZJL-IAGOWNOFSA-N 1 1 383.305 3.335 10 0 GGAEMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C[C@@H]1C ZINC000498567225 567185930 /nfs/dbraw/zinc/18/59/30/567185930.db2.gz MSCVLSJJTBSYIQ-RYUDHWBXSA-N 1 1 392.297 3.258 10 0 GGAEMO O=C(CCc1cc(F)ccc1Br)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000684185694 567186221 /nfs/dbraw/zinc/18/62/21/567186221.db2.gz YRSYNLZQOXTCOR-HZPDHXFCSA-N 1 1 387.268 3.166 10 0 GGAEMO C[N@H+]1C[C@H]2CCN(Cc3ccc(I)cc3Cl)[C@@H]2C1 ZINC000590010384 567204575 /nfs/dbraw/zinc/20/45/75/567204575.db2.gz GUASUONZLZUKTK-BXUZGUMPSA-N 1 1 376.669 3.081 10 0 GGAEMO C[C@H](C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1)c1ccc(Br)s1 ZINC000684185887 567187399 /nfs/dbraw/zinc/18/73/99/567187399.db2.gz YHYQHEBFBTUGCD-QJPTWQEYSA-N 1 1 375.307 3.259 10 0 GGAEMO O=C(CCc1cc(F)ccc1Br)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000684185696 567187453 /nfs/dbraw/zinc/18/74/53/567187453.db2.gz YRSYNLZQOXTCOR-JKSUJKDBSA-N 1 1 387.268 3.166 10 0 GGAEMO O=C(c1cc2cc(Br)ccc2[nH]1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000684183186 567187587 /nfs/dbraw/zinc/18/75/87/567187587.db2.gz NEOJLMWCVMHTNE-CZUORRHYSA-N 1 1 380.261 3.189 10 0 GGAEMO C[N@H+]1CCC[C@H]1CNC(=O)N1CCC(c2nc(C(F)(F)F)cs2)CC1 ZINC000454625512 567187744 /nfs/dbraw/zinc/18/77/44/567187744.db2.gz FGNOMLWBPRIFIJ-LBPRGKRZSA-N 1 1 376.448 3.145 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)Cc2c(Br)cccc2C(=O)OC)[C@H](C)C1 ZINC000432772304 567188789 /nfs/dbraw/zinc/18/87/89/567188789.db2.gz SJWSEGYEPUVJNA-DYVFJYSZSA-N 1 1 383.330 3.398 10 0 GGAEMO C[C@H](CC(=O)N1CCC[C@H]([NH+]2CCOCC2)C1)c1ccc(Br)cc1 ZINC000615548156 567188836 /nfs/dbraw/zinc/18/88/36/567188836.db2.gz SRQHZLPMDIOKQK-QAPCUYQASA-N 1 1 395.341 3.266 10 0 GGAEMO COC(=O)c1cccc(Br)c1C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000432776549 567190042 /nfs/dbraw/zinc/19/00/42/567190042.db2.gz PBVPFOJLGLHQAR-ZIAGYGMSSA-N 1 1 382.298 3.484 10 0 GGAEMO COC(=O)c1cccc(Br)c1C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000432776547 567190934 /nfs/dbraw/zinc/19/09/34/567190934.db2.gz PBVPFOJLGLHQAR-KGLIPLIRSA-N 1 1 382.298 3.484 10 0 GGAEMO Cc1nc([C@@H]2CCCCN2C(=O)c2sc3c(c2Br)C[NH2+]C3)no1 ZINC000659249728 567193638 /nfs/dbraw/zinc/19/36/38/567193638.db2.gz JONCSJUVICVVTE-JTQLQIEISA-N 1 1 397.298 3.173 10 0 GGAEMO C[N@H+]1CC[C@@H](Cn2nnnc2Sc2nc3cc(Cl)cc(Cl)c3o2)C1 ZINC000432827804 567194145 /nfs/dbraw/zinc/19/41/45/567194145.db2.gz DZPJJPCOSUHHPN-MRVPVSSYSA-N 1 1 385.280 3.224 10 0 GGAEMO O=C(N[C@H]1CCc2ccccc2C1)c1sc2c(c1Br)C[NH2+]C2 ZINC000659253673 567194164 /nfs/dbraw/zinc/19/41/64/567194164.db2.gz YIGWESVGIMDBGF-LBPRGKRZSA-N 1 1 377.307 3.401 10 0 GGAEMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)[C@H]1CCc3cc(Br)ccc31)C2 ZINC000615609581 567194561 /nfs/dbraw/zinc/19/45/61/567194561.db2.gz XFTHLNOZUUQINV-PKOBYXMFSA-N 1 1 377.326 3.423 10 0 GGAEMO C[N@H+]1CC[C@@]2(C1)CCCN(C(=O)[C@H]1CCOc3ccc(Br)cc31)C2 ZINC000615600538 567194845 /nfs/dbraw/zinc/19/48/45/567194845.db2.gz ACHLRZAFUSBGRG-HNAYVOBHSA-N 1 1 393.325 3.260 10 0 GGAEMO C[C@H](F)CCNC(=O)NC1CC[NH+](Cc2ccc(Br)cc2)CC1 ZINC000454690613 567195238 /nfs/dbraw/zinc/19/52/38/567195238.db2.gz WQERKQZBHUCMJR-ZDUSSCGKSA-N 1 1 386.309 3.461 10 0 GGAEMO Ic1cccc2ncnc(N[C@H]3CC[N@H+]4CCCC[C@@H]34)c12 ZINC000547277699 567195327 /nfs/dbraw/zinc/19/53/27/567195327.db2.gz WIYXPCRGILFDML-JSGCOSHPSA-N 1 1 394.260 3.273 10 0 GGAEMO CC1(C)[C@H](NC(=O)c2sc3c(c2Br)C[NH2+]C3)[C@@H]2CCCO[C@H]21 ZINC000659268973 567195563 /nfs/dbraw/zinc/19/55/63/567195563.db2.gz VMGVHVLLUSMNHQ-MCCGJVOXSA-N 1 1 385.327 3.047 10 0 GGAEMO COC[C@@H](Cc1ccccc1)NC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659268135 567195799 /nfs/dbraw/zinc/19/57/99/567195799.db2.gz IXXGLZQNZFLIRA-GFCCVEGCSA-N 1 1 395.322 3.101 10 0 GGAEMO CN(CCOc1ccc(F)cc1)C(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659262627 567195832 /nfs/dbraw/zinc/19/58/32/567195832.db2.gz JXJHBRINYBWGNZ-UHFFFAOYSA-N 1 1 399.285 3.404 10 0 GGAEMO COCc1ccccc1CNC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659258274 567195992 /nfs/dbraw/zinc/19/59/92/567195992.db2.gz PURSWUJXDALZQK-UHFFFAOYSA-N 1 1 381.295 3.190 10 0 GGAEMO O=C(NCCOc1ccccc1F)c1sc2c(c1Br)C[NH2+]C2 ZINC000659264064 567196340 /nfs/dbraw/zinc/19/63/40/567196340.db2.gz AKMKTIHBUJOLCA-UHFFFAOYSA-N 1 1 385.258 3.062 10 0 GGAEMO C[C@@H]1CN(c2cc(C3CC3)nc3c(Br)cccc23)CC[N@H+]1CCO ZINC000432847714 567196204 /nfs/dbraw/zinc/19/62/04/567196204.db2.gz VYLNWLNUKMLGGT-CYBMUJFWSA-N 1 1 390.325 3.378 10 0 GGAEMO COc1cc(Br)c(NC(=O)NCC[N@@H+]2CC=C(C)CC2)cc1OC ZINC000547283814 567196620 /nfs/dbraw/zinc/19/66/20/567196620.db2.gz QPVFPGTZSHKXRC-UHFFFAOYSA-N 1 1 398.301 3.240 10 0 GGAEMO O=C(N[C@H]1C[C@H]1Cc1ccccc1)c1sc2c(c1Br)C[NH2+]C2 ZINC000659267842 567196612 /nfs/dbraw/zinc/19/66/12/567196612.db2.gz DYKWPGSGAYNWAY-YPMHNXCESA-N 1 1 377.307 3.475 10 0 GGAEMO CCO[C@H]1C[C@@H](NC(=O)c2sc3c(c2Br)C[NH2+]C3)C12CCC2 ZINC000659268657 567196772 /nfs/dbraw/zinc/19/67/72/567196772.db2.gz RTHAUCUUKRMFPJ-NEPJUHHUSA-N 1 1 385.327 3.191 10 0 GGAEMO COc1ccc2c(c1)CN(C(=O)c1sc3c(c1Br)C[NH2+]C3)CC2 ZINC000659273606 567197424 /nfs/dbraw/zinc/19/74/24/567197424.db2.gz GOHRRUYFAGAXTC-UHFFFAOYSA-N 1 1 393.306 3.321 10 0 GGAEMO C[NH2+][C@@H](C(=O)NC[C@@H]1COc2ccccc2O1)c1cccc(Cl)c1Cl ZINC000659280396 567197685 /nfs/dbraw/zinc/19/76/85/567197685.db2.gz BEFCTCZBVXBGPP-PIGZYNQJSA-N 1 1 381.259 3.210 10 0 GGAEMO O=C(NCc1ccc(Cl)cc1Cl)[C@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000524395152 567198135 /nfs/dbraw/zinc/19/81/35/567198135.db2.gz FBDAMCMTVKUZMP-IBGZPJMESA-N 1 1 379.287 3.247 10 0 GGAEMO Cc1noc(C)c1C[C@@H](C)NC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659274341 567198171 /nfs/dbraw/zinc/19/81/71/567198171.db2.gz VVMKNRWNBZEZDO-SSDOTTSWSA-N 1 1 384.299 3.080 10 0 GGAEMO CC(C)[C@H]1OCCC[C@H]1CNC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659277196 567198284 /nfs/dbraw/zinc/19/82/84/567198284.db2.gz YQQBOTYNSVKLIX-IINYFYTJSA-N 1 1 387.343 3.295 10 0 GGAEMO CCO[C@H](CCNC(=O)c1sc2c(c1Br)C[NH2+]C2)C(C)C ZINC000659282146 567198458 /nfs/dbraw/zinc/19/84/58/567198458.db2.gz NVGJZWINYOMARZ-LLVKDONJSA-N 1 1 375.332 3.295 10 0 GGAEMO C[C@H](COc1cccc(F)c1)NC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659281804 567198536 /nfs/dbraw/zinc/19/85/36/567198536.db2.gz XCCUVPAMRKNGCP-SECBINFHSA-N 1 1 399.285 3.450 10 0 GGAEMO COc1ccc2c(c1)CCN2C(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659270564 567198725 /nfs/dbraw/zinc/19/87/25/567198725.db2.gz FADXQEDCWRTZJV-UHFFFAOYSA-N 1 1 379.279 3.325 10 0 GGAEMO CN(Cc1ccc2c(c1)OCO2)C(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659272094 567198759 /nfs/dbraw/zinc/19/87/59/567198759.db2.gz FEMQHNNBFAGTDF-UHFFFAOYSA-N 1 1 395.278 3.115 10 0 GGAEMO Cn1ccnc1C[NH+]1CCC(C(=O)Nc2cscc2Br)CC1 ZINC000615729540 567201055 /nfs/dbraw/zinc/20/10/55/567201055.db2.gz DPPYGRTWLOEJHB-UHFFFAOYSA-N 1 1 383.315 3.095 10 0 GGAEMO COc1ccccc1CCNC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659296768 567202299 /nfs/dbraw/zinc/20/22/99/567202299.db2.gz IFNZCTBCFDXTRC-UHFFFAOYSA-N 1 1 381.295 3.095 10 0 GGAEMO C[NH2+][C@H](C(=O)NCCc1cnc(C2CC2)nc1)c1cccc(Cl)c1Cl ZINC000659317991 567203669 /nfs/dbraw/zinc/20/36/69/567203669.db2.gz XAWCTRKIDQITLH-INIZCTEOSA-N 1 1 379.291 3.280 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CC[C@@H](C2CCOCC2)C1 ZINC000659314511 567204010 /nfs/dbraw/zinc/20/40/10/567204010.db2.gz JUDANSAYXHEQTJ-LLVKDONJSA-N 1 1 385.327 3.003 10 0 GGAEMO C[N@H+]1C[C@@H]2CCN(Cc3ccc(I)cc3Cl)[C@@H]2C1 ZINC000590010390 567204651 /nfs/dbraw/zinc/20/46/51/567204651.db2.gz GUASUONZLZUKTK-SMDDNHRTSA-N 1 1 376.669 3.081 10 0 GGAEMO Cc1c(Br)cncc1C(=O)N1CC[NH2+]C[C@H]1c1cccc(F)c1 ZINC000659307529 567204708 /nfs/dbraw/zinc/20/47/08/567204708.db2.gz OQODETQMRKMQKW-INIZCTEOSA-N 1 1 378.245 3.078 10 0 GGAEMO COc1c(C)cccc1CNC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659329378 567205387 /nfs/dbraw/zinc/20/53/87/567205387.db2.gz IRTNKFZOMOHCJR-UHFFFAOYSA-N 1 1 381.295 3.361 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCc2cccc(F)c2C1 ZINC000659320239 567205577 /nfs/dbraw/zinc/20/55/77/567205577.db2.gz DLYXWKZQDHOLRS-UHFFFAOYSA-N 1 1 381.270 3.451 10 0 GGAEMO Cc1csc([C@@H](C)CNC(=O)c2sc3c(c2Br)C[NH2+]C3)n1 ZINC000659324288 567205661 /nfs/dbraw/zinc/20/56/61/567205661.db2.gz LTGHFHPYCHWCTQ-ZETCQYMHSA-N 1 1 386.340 3.412 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCc2ccc(F)cc2C1 ZINC000659320188 567206570 /nfs/dbraw/zinc/20/65/70/567206570.db2.gz CZPXLSNYSHEBPB-UHFFFAOYSA-N 1 1 381.270 3.451 10 0 GGAEMO COCC[C@H]1CCCCN(C(=O)c2sc3c(c2Br)C[NH2+]C3)C1 ZINC000659322987 567206698 /nfs/dbraw/zinc/20/66/98/567206698.db2.gz BHYOSJNFYUWUCS-LLVKDONJSA-N 1 1 387.343 3.393 10 0 GGAEMO Cc1nc2ccc(Br)cn2c1C(=O)NCC[N@@H+]1CCCC[C@@H]1C ZINC000474904130 567208572 /nfs/dbraw/zinc/20/85/72/567208572.db2.gz DMHXGLXBTIPMNK-LBPRGKRZSA-N 1 1 379.302 3.009 10 0 GGAEMO COc1ccc2c(c1)CCN(C(=O)c1sc3c(c1Br)C[NH2+]C3)C2 ZINC000659368446 567209054 /nfs/dbraw/zinc/20/90/54/567209054.db2.gz NYVHKXXMASLXAG-UHFFFAOYSA-N 1 1 393.306 3.321 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)COc1cc(Cl)c(Cl)cc1Cl ZINC000590119472 567209576 /nfs/dbraw/zinc/20/95/76/567209576.db2.gz YUVPUSZXFHKSNR-NSHDSACASA-N 1 1 395.714 3.253 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)c1csc(-c2ccccc2Cl)n1 ZINC000590115985 567209889 /nfs/dbraw/zinc/20/98/89/567209889.db2.gz NPUMYRPYTCELAU-ZDUSSCGKSA-N 1 1 379.913 3.304 10 0 GGAEMO Nc1ccc2c(c1)CC[C@@H]2NC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000659364476 567210166 /nfs/dbraw/zinc/21/01/66/567210166.db2.gz OMRXFSDIOVYBTA-LBPRGKRZSA-N 1 1 378.295 3.113 10 0 GGAEMO C[N@@H+](CCCCNC(=O)N[C@@H]1CCOc2c(Br)cccc21)C1CC1 ZINC000454894005 567210621 /nfs/dbraw/zinc/21/06/21/567210621.db2.gz AEJKBTOHHXUTJI-MRXNPFEDSA-N 1 1 396.329 3.446 10 0 GGAEMO C[C@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)N[C@@H]1[C@H]2Cc3cc(Br)ccc3[C@@H]12 ZINC000637651165 567211195 /nfs/dbraw/zinc/21/11/95/567211195.db2.gz UHYLHEDPINDIAV-PXALQNAGSA-N 1 1 392.341 3.069 10 0 GGAEMO CCN(CC(F)(F)F)C(=O)[C@@H]1CCCN(c2cc[nH+]cc2Br)C1 ZINC000547503241 567215311 /nfs/dbraw/zinc/21/53/11/567215311.db2.gz BTJDJMKHBMZFGN-LLVKDONJSA-N 1 1 394.235 3.471 10 0 GGAEMO O=C(NC[C@H]1CCCC[N@@H+]1CCO)Nc1ccc(Cl)c(Br)c1 ZINC000454941506 567215882 /nfs/dbraw/zinc/21/58/82/567215882.db2.gz KQNHJABCWKAOHS-GFCCVEGCSA-N 1 1 390.709 3.071 10 0 GGAEMO COC(=O)c1ccc(Br)cc1C[N@@H+](C)C[C@@H](O)Cc1ccccc1 ZINC000433038075 567217632 /nfs/dbraw/zinc/21/76/32/567217632.db2.gz FJTRKBOJOXTPCK-KRWDZBQOSA-N 1 1 392.293 3.271 10 0 GGAEMO Cc1cc(C)c(NC(=O)NC[C@H]2CCCC[N@H+]2CCO)c(Br)c1 ZINC000454990403 567220298 /nfs/dbraw/zinc/22/02/98/567220298.db2.gz KSQJHYOFTANIOF-CQSZACIVSA-N 1 1 384.318 3.034 10 0 GGAEMO Cc1cc(Br)c(CNC(=O)N2CC[NH2+]C[C@H]2c2cccnc2)s1 ZINC000659600240 567221680 /nfs/dbraw/zinc/22/16/80/567221680.db2.gz BBEPPKVAGRJUHT-AWEZNQCLSA-N 1 1 395.326 3.070 10 0 GGAEMO CC[C@@H]1C[N@@H+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C[C@]2(CCOC2)O1 ZINC000684626374 567221869 /nfs/dbraw/zinc/22/18/69/567221869.db2.gz XRWBOQPXSNWDMV-LBTNJELSSA-N 1 1 390.307 3.003 10 0 GGAEMO C[C@H](Nc1ccc2c(c1)C[N@@H+](CC(N)=O)CC2)c1cccc(Br)c1 ZINC000433094005 567222149 /nfs/dbraw/zinc/22/21/49/567222149.db2.gz SRVJXFXCNIDKNO-ZDUSSCGKSA-N 1 1 388.309 3.466 10 0 GGAEMO C[C@H](Nc1ccc2c(c1)C[N@H+](CC(N)=O)CC2)c1cccc(Br)c1 ZINC000433094005 567222155 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389.334 3.420 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)CCOc2cccc(Br)c2)[C@H](C)C1 ZINC000525621967 567255529 /nfs/dbraw/zinc/25/55/29/567255529.db2.gz JIKDWGFJBFKRCN-RHSMWYFYSA-N 1 1 383.330 3.407 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)C(=O)CCOc2ccccc2Br)[C@@H](C)C1 ZINC000525621921 567255730 /nfs/dbraw/zinc/25/57/30/567255730.db2.gz GKBCQEQGCRUEFJ-HOCLYGCPSA-N 1 1 383.330 3.407 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)NC[C@@H](C)[N@H+]1CCCC[C@@H]1C ZINC000525657166 567256555 /nfs/dbraw/zinc/25/65/55/567256555.db2.gz KYWJHDHOXKWIDP-UONOGXRCSA-N 1 1 383.330 3.379 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)NC[C@H](C)[N@H+]1CCCC[C@H]1C ZINC000525657165 567257110 /nfs/dbraw/zinc/25/71/10/567257110.db2.gz KYWJHDHOXKWIDP-KGLIPLIRSA-N 1 1 383.330 3.379 10 0 GGAEMO C[C@H](C(=O)Nc1cccc(Br)c1)[N@H+]1CCC[C@@H](n2ccnc2)C1 ZINC000591081508 567262864 /nfs/dbraw/zinc/26/28/64/567262864.db2.gz DKGWYNGNAIVOMM-CZUORRHYSA-N 1 1 377.286 3.310 10 0 GGAEMO COc1c(Br)cc(Cl)cc1NC(=O)N1CC[NH+](C2CC2)CC1 ZINC000525734658 567263080 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567420650 /nfs/dbraw/zinc/42/06/50/567420650.db2.gz QFCOGRDNXPASPA-UHFFFAOYSA-N 1 1 397.361 3.236 10 0 GGAEMO COc1ccc([C@@H]([NH2+]C[C@H]2CNCCO2)c2ccccc2)cc1Br ZINC000662259570 567422133 /nfs/dbraw/zinc/42/21/33/567422133.db2.gz YWPRUFMSMBGVSZ-APWZRJJASA-N 1 1 391.309 3.125 10 0 GGAEMO C[C@@H]1C[N@H+](CCC(=O)NCc2ccccc2Cl)C[C@H](CC(F)(F)F)O1 ZINC000662242263 567422212 /nfs/dbraw/zinc/42/22/12/567422212.db2.gz MMJOPYRDZWXXED-OCCSQVGLSA-N 1 1 378.822 3.388 10 0 GGAEMO C[C@@H]1C[N@@H+](CCC(=O)NCc2ccccc2Cl)C[C@H](CC(F)(F)F)O1 ZINC000662242263 567422215 /nfs/dbraw/zinc/42/22/15/567422215.db2.gz MMJOPYRDZWXXED-OCCSQVGLSA-N 1 1 378.822 3.388 10 0 GGAEMO COc1ccc([C@H]([NH2+]C[C@H]2CNCCO2)c2ccccc2)cc1Br ZINC000662259574 567422588 /nfs/dbraw/zinc/42/25/88/567422588.db2.gz YWPRUFMSMBGVSZ-VQIMIIECSA-N 1 1 391.309 3.125 10 0 GGAEMO C[C@H]1C[N@H+](CCC(=O)N2CCc3sccc3C2)C[C@H](CC(F)(F)F)O1 ZINC000662245374 567422828 /nfs/dbraw/zinc/42/28/28/567422828.db2.gz WCDOERKDKFUEKA-JSGCOSHPSA-N 1 1 376.444 3.065 10 0 GGAEMO C[C@H]1C[N@@H+](CCC(=O)N2CCc3sccc3C2)C[C@H](CC(F)(F)F)O1 ZINC000662245374 567422834 /nfs/dbraw/zinc/42/28/34/567422834.db2.gz WCDOERKDKFUEKA-JSGCOSHPSA-N 1 1 376.444 3.065 10 0 GGAEMO CC[N@H+]1CCC[C@@H](NC(=O)c2scc(Br)c2Br)C1 ZINC000528434796 567423103 /nfs/dbraw/zinc/42/31/03/567423103.db2.gz CCRUCAMAFFSNGZ-MRVPVSSYSA-N 1 1 396.148 3.487 10 0 GGAEMO Brc1cccc(C[C@H]2CCCCN2C[C@H]2CCC3(C[NH2+]C3)O2)c1 ZINC000662282066 567424031 /nfs/dbraw/zinc/42/40/31/567424031.db2.gz CQJRHOIGLNQJJG-QZTJIDSGSA-N 1 1 379.342 3.367 10 0 GGAEMO O=C(NCCSc1ccc(Cl)cc1)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC000569695415 567424262 /nfs/dbraw/zinc/42/42/62/567424262.db2.gz ZHUYNOKMJYUOKZ-QGZVFWFLSA-N 1 1 376.913 3.183 10 0 GGAEMO O=C(NCCSc1ccc(Cl)cc1)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000569695414 567424502 /nfs/dbraw/zinc/42/45/02/567424502.db2.gz ZHUYNOKMJYUOKZ-KRWDZBQOSA-N 1 1 376.913 3.183 10 0 GGAEMO Brc1cccc(C[C@H]2CCCCN2C[C@@H]2CCC3(C[NH2+]C3)O2)c1 ZINC000662282065 567424630 /nfs/dbraw/zinc/42/46/30/567424630.db2.gz CQJRHOIGLNQJJG-MSOLQXFVSA-N 1 1 379.342 3.367 10 0 GGAEMO O[C@H](COc1ccc(Br)cc1)C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000662312798 567425593 /nfs/dbraw/zinc/42/55/93/567425593.db2.gz FEPRJYKMHKOKBF-YTQUADARSA-N 1 1 396.325 3.081 10 0 GGAEMO Brc1ccc([C@@H]2CCC[N@@H+]2CCc2nnnn2-c2ccccc2)nc1 ZINC000550078094 567426097 /nfs/dbraw/zinc/42/60/97/567426097.db2.gz RAKCGBPJDWVDDA-KRWDZBQOSA-N 1 1 399.296 3.199 10 0 GGAEMO Brc1ccc([C@@H]2CCC[N@H+]2CCc2nnnn2-c2ccccc2)nc1 ZINC000550078094 567426101 /nfs/dbraw/zinc/42/61/01/567426101.db2.gz RAKCGBPJDWVDDA-KRWDZBQOSA-N 1 1 399.296 3.199 10 0 GGAEMO C[N@H+]1CCCC[C@@H]1CN1CCN(C(=O)Cc2cc(Cl)cc(Cl)c2)CC1 ZINC000528465348 567426441 /nfs/dbraw/zinc/42/64/41/567426441.db2.gz IKGCUFAYFTZHCS-GOSISDBHSA-N 1 1 384.351 3.164 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CN1CCN(C(=O)c2ccsc2C(F)(F)F)CC1 ZINC000528466848 567427172 /nfs/dbraw/zinc/42/71/72/567427172.db2.gz RFWKEOPLDKBCSC-ZDUSSCGKSA-N 1 1 375.460 3.009 10 0 GGAEMO C[C@H](CCc1ccc(I)cc1)[NH2+][C@@H]1CCc2[nH]cnc2C1 ZINC000569746750 567427995 /nfs/dbraw/zinc/42/79/95/567427995.db2.gz DKDBHKVSVHGSFN-IUODEOHRSA-N 1 1 395.288 3.483 10 0 GGAEMO C[N@H+]1CCCC[C@@H]1CN1CCN(C(=O)c2ccsc2C(F)(F)F)CC1 ZINC000528466846 567428021 /nfs/dbraw/zinc/42/80/21/567428021.db2.gz RFWKEOPLDKBCSC-CYBMUJFWSA-N 1 1 375.460 3.009 10 0 GGAEMO COc1ccc(OC)c([C@@H](C)NC(=O)[C@H]([NH3+])c2ccccc2Br)c1 ZINC000662352055 567428540 /nfs/dbraw/zinc/42/85/40/567428540.db2.gz RJOLGIUQWUDNAA-PIGZYNQJSA-N 1 1 393.281 3.344 10 0 GGAEMO CCc1cc(Br)ccc1NC(=O)NC[C@H]1CCC[N@H+]1CCOC ZINC000477972420 567428737 /nfs/dbraw/zinc/42/87/37/567428737.db2.gz DHFZXYXQTRYCBW-OAHLLOKOSA-N 1 1 384.318 3.244 10 0 GGAEMO CCc1cc(Br)ccc1NC(=O)NC[C@@H]1CCC[N@H+]1CCOC ZINC000477972419 567428842 /nfs/dbraw/zinc/42/88/42/567428842.db2.gz DHFZXYXQTRYCBW-HNNXBMFYSA-N 1 1 384.318 3.244 10 0 GGAEMO C/C(=C\c1ccccc1C(F)(F)F)C[N@H+]1CCC[C@@H](CS(N)(=O)=O)C1 ZINC000502344833 567429957 /nfs/dbraw/zinc/42/99/57/567429957.db2.gz KAVKTFBEEOFTMW-KADHNRKRSA-N 1 1 376.444 3.109 10 0 GGAEMO COc1ccc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)cc1Br ZINC000456981560 567430399 /nfs/dbraw/zinc/43/03/99/567430399.db2.gz FWCQRESWOGTDGX-MRXNPFEDSA-N 1 1 375.266 3.244 10 0 GGAEMO O=C(Cc1c(F)ccc(Br)c1F)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000456979314 567430491 /nfs/dbraw/zinc/43/04/91/567430491.db2.gz AQHXVUDOJLAWRM-INIZCTEOSA-N 1 1 395.247 3.443 10 0 GGAEMO C[C@@H](Oc1ccccc1Br)C(=O)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000456982833 567430819 /nfs/dbraw/zinc/43/08/19/567430819.db2.gz GUIMNLKZNXMDKU-RHSMWYFYSA-N 1 1 389.293 3.390 10 0 GGAEMO O=C(c1csc(I)c1)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000457004702 567431533 /nfs/dbraw/zinc/43/15/33/567431533.db2.gz YGEQAEQFSSDBNK-CYBMUJFWSA-N 1 1 398.269 3.139 10 0 GGAEMO O=C(Cc1ccc(Br)c(F)c1)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000457007631 567431701 /nfs/dbraw/zinc/43/17/01/567431701.db2.gz BXVMIULHAPCCAF-KRWDZBQOSA-N 1 1 377.257 3.304 10 0 GGAEMO C[C@H](CNC(=O)c1sc2c(c1Br)C[NH2+]C2)N(C)c1ccccc1 ZINC000662387969 567431898 /nfs/dbraw/zinc/43/18/98/567431898.db2.gz NNKQMEYZUKADLF-LLVKDONJSA-N 1 1 394.338 3.369 10 0 GGAEMO C[N@H+]1CC[C@H](NC(=O)c2ccc(Br)cc2O)[C@@H]1c1ccccc1 ZINC000436524735 567431955 /nfs/dbraw/zinc/43/19/55/567431955.db2.gz KJKBJQGNVUORHO-RDJZCZTQSA-N 1 1 375.266 3.330 10 0 GGAEMO COc1cc(CN(C)C(=O)c2sc3c(c2Br)C[NH2+]C3)ccc1O ZINC000662376674 567431918 /nfs/dbraw/zinc/43/19/18/567431918.db2.gz DNLDXXSCIMPUNB-UHFFFAOYSA-N 1 1 397.294 3.100 10 0 GGAEMO COc1ccc(Br)c(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC000457001469 567432181 /nfs/dbraw/zinc/43/21/81/567432181.db2.gz VULQITQHQHPJSD-QGZVFWFLSA-N 1 1 375.266 3.244 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CN(Cc1ccncc1)C(=O)[C@H]1C[C@]1(C)Br ZINC000528513154 567432381 /nfs/dbraw/zinc/43/23/81/567432381.db2.gz RLLZGHHBTSHWSJ-NUJGCVRESA-N 1 1 380.330 3.068 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCC[C@@H]1c1ccccn1 ZINC000662405839 567432708 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Cc1c(S(=O)(=O)NC[C@H](c2cccs2)[NH+](C)C)c2ccccc2n1C ZINC000551445622 567507805 /nfs/dbraw/zinc/50/78/05/567507805.db2.gz POEYVJIBRFLGNW-MRXNPFEDSA-N 1 1 377.535 3.129 10 0 GGAEMO CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CSC[C@H]1C[N@H+](C)CCO1 ZINC000570717807 567508020 /nfs/dbraw/zinc/50/80/20/567508020.db2.gz GAEZNIZEJNGXEU-OAHLLOKOSA-N 1 1 377.337 3.016 10 0 GGAEMO CN(Cc1cc(Cl)cc(Cl)c1)C(=O)CSC[C@H]1C[N@@H+](C)CCO1 ZINC000570717807 567508025 /nfs/dbraw/zinc/50/80/25/567508025.db2.gz GAEZNIZEJNGXEU-OAHLLOKOSA-N 1 1 377.337 3.016 10 0 GGAEMO C[NH2+]C[C@@H]1CCCN(C(=O)N[C@@H](CN(C)C)c2ccc(Cl)c(Cl)c2)C1 ZINC000529380767 567511022 /nfs/dbraw/zinc/51/10/22/567511022.db2.gz ARGUOEWKEADTFD-GUYCJALGSA-N 1 1 387.355 3.237 10 0 GGAEMO CC[C@@H]1CN(C(=O)N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)CC[C@H]1[NH3+] ZINC000529380777 567511330 /nfs/dbraw/zinc/51/13/30/567511330.db2.gz AXQRPQGVTBDGDJ-CSMYWGQOSA-N 1 1 387.355 3.365 10 0 GGAEMO C[C@H]([NH3+])C1CCN(C(=O)N[C@H](CN(C)C)c2ccc(Cl)c(Cl)c2)CC1 ZINC000529385384 567511494 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ZPESLIYYGXJIMM-RYUDHWBXSA-N 1 1 379.302 3.176 10 0 GGAEMO C[C@@H](CNC(=O)c1cc(Br)cc2nc[nH]c21)[N@@H+]1CCC[C@H](C)C1 ZINC000503975998 567516331 /nfs/dbraw/zinc/51/63/31/567516331.db2.gz ZPESLIYYGXJIMM-RYUDHWBXSA-N 1 1 379.302 3.176 10 0 GGAEMO C[C@@H](CNC(=O)c1cc(Br)cc2nc[nH]c21)[N@H+]1CCC[C@H](C)C1 ZINC000503975998 567516340 /nfs/dbraw/zinc/51/63/40/567516340.db2.gz ZPESLIYYGXJIMM-RYUDHWBXSA-N 1 1 379.302 3.176 10 0 GGAEMO Cc1cc(Br)c(C[NH+]2CCC(C(N)=O)CC2)cc1Br ZINC000529514277 567522212 /nfs/dbraw/zinc/52/22/12/567522212.db2.gz BFWOCTCUQHTMQL-UHFFFAOYSA-N 1 1 390.119 3.217 10 0 GGAEMO Cn1nc(C2CC2)nc1C[NH2+]C1(c2ccc(Br)cc2)CCOCC1 ZINC000570958138 567525814 /nfs/dbraw/zinc/52/58/14/567525814.db2.gz ILGWJEQPRYLMJF-UHFFFAOYSA-N 1 1 391.313 3.251 10 0 GGAEMO Cc1cc(C[NH2+]Cc2cn(C3CCC3)nn2)ccc1I ZINC000594938878 567527047 /nfs/dbraw/zinc/52/70/47/567527047.db2.gz XAOCDSSDRWFFLV-UHFFFAOYSA-N 1 1 382.249 3.206 10 0 GGAEMO Clc1ccc(C[NH2+]Cc2cnn3c2CCC3)c(I)c1 ZINC000594939915 567527163 /nfs/dbraw/zinc/52/71/63/567527163.db2.gz UWYQNOGGAZGCTF-UHFFFAOYSA-N 1 1 387.652 3.377 10 0 GGAEMO Cc1ccc(I)c(C(=O)NCC[C@H]2CCC[N@H+](C)C2)c1 ZINC000458155933 567527390 /nfs/dbraw/zinc/52/73/90/567527390.db2.gz BFQHEICYJRLVGI-CYBMUJFWSA-N 1 1 386.277 3.061 10 0 GGAEMO Clc1ccc(I)c(C[NH2+][C@@H]2CCc3[nH]cnc3C2)c1 ZINC000594943192 567527489 /nfs/dbraw/zinc/52/74/89/567527489.db2.gz ICAHHYXHLQYETM-LLVKDONJSA-N 1 1 387.652 3.315 10 0 GGAEMO C[N@H+]1CCC[C@H](CCNC(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C1 ZINC000458164663 567527847 /nfs/dbraw/zinc/52/78/47/567527847.db2.gz KOSUYOOMOZLTDG-GFCCVEGCSA-N 1 1 392.297 3.165 10 0 GGAEMO Cc1ccc(NCCCNC(=O)C(C)(C)c2cccc(Br)c2)[nH+]c1 ZINC000479376982 567529588 /nfs/dbraw/zinc/52/95/88/567529588.db2.gz AIWKZWAOKRAMEI-UHFFFAOYSA-N 1 1 390.325 3.470 10 0 GGAEMO C[N@H+]1CCCC[C@@H]1CCC(=O)N[C@H](CCO)c1ccccc1Br ZINC000504319693 567529727 /nfs/dbraw/zinc/52/97/27/567529727.db2.gz AIFJBNINEORIEU-RHSMWYFYSA-N 1 1 383.330 3.253 10 0 GGAEMO C[C@@H](Cc1ccc(Br)cc1)NC(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC000594977095 567530310 /nfs/dbraw/zinc/53/03/10/567530310.db2.gz YCNPUXKLDKELRR-SUMWQHHRSA-N 1 1 380.330 3.164 10 0 GGAEMO CCN(C(=O)N[C@@H]1CCOc2ccc(Br)cc21)[C@H]1CC[N@@H+](CC)C1 ZINC000663786596 567530885 /nfs/dbraw/zinc/53/08/85/567530885.db2.gz IURUIHWXFPCLAT-GOEBONIOSA-N 1 1 396.329 3.398 10 0 GGAEMO C[C@H](Cc1ccc(Br)cc1)NC(=O)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000594977093 567530859 /nfs/dbraw/zinc/53/08/59/567530859.db2.gz YCNPUXKLDKELRR-DYVFJYSZSA-N 1 1 380.330 3.164 10 0 GGAEMO Cc1cc(Br)cc(C)c1CNC(=O)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000594979418 567530893 /nfs/dbraw/zinc/53/08/93/567530893.db2.gz CYZZRMOCJXCNMD-INIZCTEOSA-N 1 1 380.330 3.349 10 0 GGAEMO Fc1ccc(I)c(F)c1C[NH2+]CCO[C@@H]1CC1(F)F ZINC000594971316 567531422 /nfs/dbraw/zinc/53/14/22/567531422.db2.gz DSMVIBRDTZJDPG-SNVBAGLBSA-N 1 1 389.130 3.083 10 0 GGAEMO CCNC(=O)C[C@H]1CCCC[N@H+]1Cc1ccc(OC)c(OC)c1Br ZINC000551720785 567531657 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CCN(C(=O)NCc1ccc(OC)c(Br)c1)[C@@H]1CC[N@@H+](CC)C1 ZINC000663916709 567541995 /nfs/dbraw/zinc/54/19/95/567541995.db2.gz WVRFULZHQOHOFA-CQSZACIVSA-N 1 1 384.318 3.083 10 0 GGAEMO Ic1ccc(CC[NH2+]C2CCN(CC3CC3)CC2)cc1 ZINC000595096133 567542426 /nfs/dbraw/zinc/54/24/26/567542426.db2.gz WHLRKINMBOLIKK-UHFFFAOYSA-N 1 1 384.305 3.298 10 0 GGAEMO O=C(CNC1(c2ccc(Cl)c(Cl)c2)CC1)NC1CC[NH+](C2CC2)CC1 ZINC000438740472 567542632 /nfs/dbraw/zinc/54/26/32/567542632.db2.gz OHQWRFKBSSCRQW-UHFFFAOYSA-N 1 1 382.335 3.315 10 0 GGAEMO CCN(CC)C(=O)[C@@H]1CCC[N@H+]1C[C@@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000620807827 567544327 /nfs/dbraw/zinc/54/43/27/567544327.db2.gz ANZZTWMTGAJNBG-DYVFJYSZSA-N 1 1 389.323 3.066 10 0 GGAEMO C[C@H]1CCCC[N@H+]1CCNC(=O)C1(c2cccc(Br)c2)CC(=O)C1 ZINC000438774835 567544956 /nfs/dbraw/zinc/54/49/56/567544956.db2.gz SEJXQGAJEOOWQM-AWEZNQCLSA-N 1 1 393.325 3.040 10 0 GGAEMO CCN(CC)C(=O)[C@H]1CCC[N@H+]1C[C@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000620807829 567545052 /nfs/dbraw/zinc/54/50/52/567545052.db2.gz ANZZTWMTGAJNBG-SUMWQHHRSA-N 1 1 389.323 3.066 10 0 GGAEMO CC(C)[N@H+]1CC[C@H](CNC(=O)N[C@@H]2CCc3cc(Br)ccc32)C1 ZINC000620816663 567546063 /nfs/dbraw/zinc/54/60/63/567546063.db2.gz GXSLBAZXAFNOCP-CXAGYDPISA-N 1 1 380.330 3.466 10 0 GGAEMO COc1ncc(C[N@@H+]2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)cc1Cl ZINC000551994114 567547317 /nfs/dbraw/zinc/54/73/17/567547317.db2.gz COBSRSRBTODVRQ-NSHDSACASA-N 1 1 379.810 3.024 10 0 GGAEMO COc1ncc(C[N@H+]2CCC[C@@H](CNC(=O)CC(F)(F)F)C2)cc1Cl ZINC000551994114 567547323 /nfs/dbraw/zinc/54/73/23/567547323.db2.gz COBSRSRBTODVRQ-NSHDSACASA-N 1 1 379.810 3.024 10 0 GGAEMO COc1cccc([C@H]2[C@H](NS(=O)(=O)c3ccsc3)CC[N@@H+]2C2CC2)c1 ZINC000551984080 567547953 /nfs/dbraw/zinc/54/79/53/567547953.db2.gz MZBCAGMTMOMUFY-MSOLQXFVSA-N 1 1 378.519 3.013 10 0 GGAEMO COc1cccc([C@H]2[C@H](NS(=O)(=O)c3ccsc3)CC[N@H+]2C2CC2)c1 ZINC000551984080 567547961 /nfs/dbraw/zinc/54/79/61/567547961.db2.gz MZBCAGMTMOMUFY-MSOLQXFVSA-N 1 1 378.519 3.013 10 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ZINC000666639808 567691528 /nfs/dbraw/zinc/69/15/28/567691528.db2.gz FWDZKNQJSXWKEV-OCCSQVGLSA-N 1 1 386.359 3.445 10 0 GGAEMO CNS(=O)(=O)[C@@H]1CC[N@H+](Cc2cccc(SCc3ccccc3)c2)C1 ZINC000553888913 567695787 /nfs/dbraw/zinc/69/57/87/567695787.db2.gz NARVRJFZCSOVRU-LJQANCHMSA-N 1 1 376.547 3.102 10 0 GGAEMO CNS(=O)(=O)[C@@H]1CC[N@@H+](Cc2cccc(SCc3ccccc3)c2)C1 ZINC000553888913 567695789 /nfs/dbraw/zinc/69/57/89/567695789.db2.gz NARVRJFZCSOVRU-LJQANCHMSA-N 1 1 376.547 3.102 10 0 GGAEMO NS(=O)(=O)C[C@@H]1CCC[N@H+]1Cc1cccc(SCc2ccccc2)c1 ZINC000553888570 567696216 /nfs/dbraw/zinc/69/62/16/567696216.db2.gz IZKCJFNPMMIURP-SFHVURJKSA-N 1 1 376.547 3.232 10 0 GGAEMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@H+]1CCCc1ccccc1Br ZINC000481737746 567699342 /nfs/dbraw/zinc/69/93/42/567699342.db2.gz PQOOFNDIVROONA-CVEARBPZSA-N 1 1 384.314 3.424 10 0 GGAEMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@@H+]1Cc1ccc(OC)c(Br)c1 ZINC000481733102 567699816 /nfs/dbraw/zinc/69/98/16/567699816.db2.gz GMHPFIZNHVFAIQ-KGLIPLIRSA-N 1 1 386.286 3.000 10 0 GGAEMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@H+]1Cc1ccc(OC)c(Br)c1 ZINC000481733102 567699824 /nfs/dbraw/zinc/69/98/24/567699824.db2.gz GMHPFIZNHVFAIQ-KGLIPLIRSA-N 1 1 386.286 3.000 10 0 GGAEMO CO[C@H](C)C[N@@H+](CC(=O)N(C)Cc1cc(Br)cs1)C(C)C ZINC000532160739 567700728 /nfs/dbraw/zinc/70/07/28/567700728.db2.gz MPRPOTXDGBSENM-GFCCVEGCSA-N 1 1 377.348 3.214 10 0 GGAEMO CN(CC[N@@H+](C)C1CC1)C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000507779580 567705265 /nfs/dbraw/zinc/70/52/65/567705265.db2.gz PUGTWGMZVABKJK-OAHLLOKOSA-N 1 1 382.302 3.008 10 0 GGAEMO C[C@H](N[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1C)c1ncc(Br)cn1 ZINC000573344264 567706489 /nfs/dbraw/zinc/70/64/89/567706489.db2.gz QAHIBVHWVDISRG-ZQIUZPCESA-N 1 1 375.314 3.410 10 0 GGAEMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000507793961 567706771 /nfs/dbraw/zinc/70/67/71/567706771.db2.gz XMYRQKVFTPAKQD-CJNGLKHVSA-N 1 1 396.329 3.256 10 0 GGAEMO CN(C[C@@H]1CCC[N@@H+](C)C1)C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000507793962 567707276 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Cc1cc(NC(=O)N2CCC([N@H+]3CC[C@H](O)C3)CC2)cc(C)c1Br ZINC000666887917 567710188 /nfs/dbraw/zinc/71/01/88/567710188.db2.gz OXRYMSMDLFQCHH-INIZCTEOSA-N 1 1 396.329 3.129 10 0 GGAEMO COC[C@@](C)(CO)[NH2+]Cc1cc(Br)c(C)cc1Br ZINC000623440117 567710332 /nfs/dbraw/zinc/71/03/32/567710332.db2.gz JNPVQCTZOWZSSK-CYBMUJFWSA-N 1 1 381.108 3.007 10 0 GGAEMO O=C(Nc1ncc(C2CC[NH2+]CC2)s1)c1ccc(Br)c(O)c1 ZINC000646354613 567710450 /nfs/dbraw/zinc/71/04/50/567710450.db2.gz ANZQYHCBHNBZSD-UHFFFAOYSA-N 1 1 382.283 3.331 10 0 GGAEMO O=C(CCCc1cc(Cl)sc1Cl)N1CC(C[NH+]2CCOCC2)C1 ZINC000646355541 567711055 /nfs/dbraw/zinc/71/10/55/567711055.db2.gz PCHZPUUMOWGQSL-UHFFFAOYSA-N 1 1 377.337 3.168 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)N[C@@H](C)C[N@H+]1CCC[C@H](C)C1 ZINC000460952041 567711657 /nfs/dbraw/zinc/71/16/57/567711657.db2.gz AESSRRQWGRNRFU-KBPBESRZSA-N 1 1 383.330 3.237 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)N[C@H](C)C[N@H+]1CCC[C@@H](C)C1 ZINC000460952044 567711813 /nfs/dbraw/zinc/71/18/13/567711813.db2.gz 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ZINC000623491183 567714663 /nfs/dbraw/zinc/71/46/63/567714663.db2.gz IKLNNPNDIBPDRD-HNNXBMFYSA-N 1 1 379.346 3.410 10 0 GGAEMO Cc1cc(Br)c(C[NH2+]CC(=O)NCC2CC2)cc1Br ZINC000623486791 567715017 /nfs/dbraw/zinc/71/50/17/567715017.db2.gz IULPLSKDRAUQFL-UHFFFAOYSA-N 1 1 390.119 3.136 10 0 GGAEMO C[N@@H+](Cc1cccc(Br)c1OC[C@H]1CCCO1)CC1(O)CCC1 ZINC000442890063 567716036 /nfs/dbraw/zinc/71/60/36/567716036.db2.gz GVGGKIIZEYAVCO-OAHLLOKOSA-N 1 1 384.314 3.354 10 0 GGAEMO C[N@H+]1CCCC[C@H](CNC(=O)N[C@@H]2CCc3cc(Br)ccc32)C1 ZINC000623495560 567716155 /nfs/dbraw/zinc/71/61/55/567716155.db2.gz IEDFKSJMLSRGFV-CXAGYDPISA-N 1 1 380.330 3.468 10 0 GGAEMO Cc1cc(C[NH2+][C@@H]2CCN(Cc3ccc(F)cc3)C2=O)ncc1Br ZINC000623506783 567716456 /nfs/dbraw/zinc/71/64/56/567716456.db2.gz HOXYTEIRYQUSKW-QGZVFWFLSA-N 1 1 392.272 3.182 10 0 GGAEMO C[N@H+]1CC[C@@H](N[C@H]2CCN(c3cccc(Br)c3)C2=O)CC1(C)C ZINC000623508807 567717395 /nfs/dbraw/zinc/71/73/95/567717395.db2.gz JGULOSDAGMRZDS-ZBFHGGJFSA-N 1 1 380.330 3.017 10 0 GGAEMO Cc1cc(Br)c(C[NH2+][C@H](C)C(=O)NCCF)cc1Br ZINC000623514995 567717785 /nfs/dbraw/zinc/71/77/85/567717785.db2.gz JVESXPRFLGGMRW-SECBINFHSA-N 1 1 396.098 3.084 10 0 GGAEMO CCS(=O)(=O)c1ccc(C[NH2+]Cc2ccc(OC)c(OC3CC3)c2)s1 ZINC000623510749 567717987 /nfs/dbraw/zinc/71/79/87/567717987.db2.gz JTZBJNKXERUSMC-UHFFFAOYSA-N 1 1 381.519 3.381 10 0 GGAEMO Cc1cc(C(=O)N2CCOC[C@H]2[C@@H]2CCC[N@@H+]2C)c(C)cc1Br ZINC000646447140 567718168 /nfs/dbraw/zinc/71/81/68/567718168.db2.gz QLMUYGLXIZCTOL-IRXDYDNUSA-N 1 1 381.314 3.001 10 0 GGAEMO C[N@H+]1CCC[C@@H]1[C@H]1COCCN1C(=O)c1csc(-c2ccc(Cl)s2)n1 ZINC000646443608 567718199 /nfs/dbraw/zinc/71/81/99/567718199.db2.gz HFBOEOVDMMNCLB-CHWSQXEVSA-N 1 1 397.953 3.460 10 0 GGAEMO Cc1cc(CCC(=O)N2CCOC[C@H]2[C@H]2CCC[N@@H+]2C)ccc1Br ZINC000646456461 567718268 /nfs/dbraw/zinc/71/82/68/567718268.db2.gz UCXYXGMNWIHGPX-MSOLQXFVSA-N 1 1 395.341 3.012 10 0 GGAEMO C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)N1CCOC[C@H]1[C@@H]1CCC[N@H+]1C ZINC000646449962 567718298 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386.286 3.241 10 0 GGAEMO CCCOc1c(Br)cc(C[N@H+]2CC[C@H](C(=O)OC)C2)cc1OC ZINC000508633434 567758476 /nfs/dbraw/zinc/75/84/76/567758476.db2.gz RSBLEMSBEJNBRF-ZDUSSCGKSA-N 1 1 386.286 3.241 10 0 GGAEMO Cc1nc(S(=O)(=O)N(C)[C@@H]2CCC[N@H+](Cc3ccccc3)C2)sc1C ZINC000533253392 567761352 /nfs/dbraw/zinc/76/13/52/567761352.db2.gz LNNWRTRUQSZGJB-QGZVFWFLSA-N 1 1 379.551 3.045 10 0 GGAEMO Cc1nc(S(=O)(=O)N(C)[C@@H]2CCC[N@@H+](Cc3ccccc3)C2)sc1C ZINC000533253392 567761358 /nfs/dbraw/zinc/76/13/58/567761358.db2.gz LNNWRTRUQSZGJB-QGZVFWFLSA-N 1 1 379.551 3.045 10 0 GGAEMO COC(=O)[C@H]1CC[N@@H+](Cc2c(C)nn(-c3ccc(Br)cc3)c2C)C1 ZINC000508673833 567761608 /nfs/dbraw/zinc/76/16/08/567761608.db2.gz XOCPEJRAWLJPOF-AWEZNQCLSA-N 1 1 392.297 3.247 10 0 GGAEMO COc1ncc(Br)cc1C[NH2+][C@H](C)c1ccc(C(=O)N(C)C)cc1 ZINC000624134303 567762371 /nfs/dbraw/zinc/76/23/71/567762371.db2.gz QYMZKUUKCPATFC-GFCCVEGCSA-N 1 1 392.297 3.405 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000624138448 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10 0 GGAEMO Brc1ccccc1-n1cc(C[N@@H+]2CCC[C@]3(CCCOC3)C2)nn1 ZINC000574272901 567768425 /nfs/dbraw/zinc/76/84/25/567768425.db2.gz IQUMPWMAWRNSHV-SFHVURJKSA-N 1 1 391.313 3.422 10 0 GGAEMO Brc1ccccc1-n1cc(C[N@H+]2CCC[C@]3(CCCOC3)C2)nn1 ZINC000574272901 567768432 /nfs/dbraw/zinc/76/84/32/567768432.db2.gz IQUMPWMAWRNSHV-SFHVURJKSA-N 1 1 391.313 3.422 10 0 GGAEMO NS(=O)(=O)c1ccc(C[NH2+][C@H]2CCCOc3c(Cl)cccc32)c(F)c1 ZINC000647199691 567769151 /nfs/dbraw/zinc/76/91/51/567769151.db2.gz MTESCDFORHMGLX-INIZCTEOSA-N 1 1 384.860 3.130 10 0 GGAEMO COc1ncncc1C[NH2+][C@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O ZINC000647205610 567769508 /nfs/dbraw/zinc/76/95/08/567769508.db2.gz IJRQUPIQAMKDJM-AWEZNQCLSA-N 1 1 381.263 3.077 10 0 GGAEMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cccc(C)c1I ZINC000598465589 567770339 /nfs/dbraw/zinc/77/03/39/567770339.db2.gz GMGWCLBMTZITJR-UHFFFAOYSA-N 1 1 388.293 3.450 10 0 GGAEMO COc1ccc(Br)cc1C1([NH2+]Cc2ccc(C(=O)N(C)C)[nH]2)CC1 ZINC000647224219 567772624 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Cc1[nH+]ccn1-c1ccc([C@@H](C)NS(=O)(=O)c2cncc(Cl)c2)cc1 ZINC000533632190 567779065 /nfs/dbraw/zinc/77/90/65/567779065.db2.gz AAINMASUHCMIEF-GFCCVEGCSA-N 1 1 376.869 3.269 10 0 GGAEMO Cc1[nH+]ccn1-c1ccc([C@H](C)NS(=O)(=O)c2cncc(Cl)c2)cc1 ZINC000533632191 567779142 /nfs/dbraw/zinc/77/91/42/567779142.db2.gz AAINMASUHCMIEF-LBPRGKRZSA-N 1 1 376.869 3.269 10 0 GGAEMO C[C@]1(CNS(=O)(=O)CCc2cccs2)CCC[N@H+]1Cc1ccccc1 ZINC000443895983 567779183 /nfs/dbraw/zinc/77/91/83/567779183.db2.gz LJUMHCPNXCUWLZ-LJQANCHMSA-N 1 1 378.563 3.265 10 0 GGAEMO C[C@H](Cc1cc(Br)ccc1F)NC(=O)N1CC[NH+](C2CC2)CC1 ZINC000533671410 567780725 /nfs/dbraw/zinc/78/07/25/567780725.db2.gz QLPLPDBNMXWMPV-GFCCVEGCSA-N 1 1 384.293 3.009 10 0 GGAEMO C[N@H+]1CCC[C@]2(CCN(S(=O)(=O)Cc3ccc(Cl)cc3Cl)C2)C1 ZINC000555405962 567782120 /nfs/dbraw/zinc/78/21/20/567782120.db2.gz MZOVKWNRIBONDG-INIZCTEOSA-N 1 1 377.337 3.241 10 0 GGAEMO C[N@H+]1CCC[C@@]2(CCN(S(=O)(=O)Cc3ccc(Cl)cc3Cl)C2)C1 ZINC000555405966 567782561 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CC[C@@H](CO)[NH+]1CCN(c2nnc(-c3cc(Cl)cc(Cl)c3)s2)CC1 ZINC000444076248 567789731 /nfs/dbraw/zinc/78/97/31/567789731.db2.gz LLCUKWAYKAQRGM-AWEZNQCLSA-N 1 1 387.336 3.405 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)N[C@@H]1C[N@H+](C)Cc2ccccc21 ZINC000533831640 567789907 /nfs/dbraw/zinc/78/99/07/567789907.db2.gz IYNMITYNTRLQLF-QGZVFWFLSA-N 1 1 389.293 3.303 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)N[C@@H]1C[N@@H+](C)Cc2ccccc21 ZINC000533831640 567789910 /nfs/dbraw/zinc/78/99/10/567789910.db2.gz IYNMITYNTRLQLF-QGZVFWFLSA-N 1 1 389.293 3.303 10 0 GGAEMO C[N@H+]1CCCC[C@H](CNC(=O)NCc2ccc(Br)c(F)c2F)C1 ZINC000624608755 567790300 /nfs/dbraw/zinc/79/03/00/567790300.db2.gz HRWXKLIKJLNZOW-LLVKDONJSA-N 1 1 390.272 3.258 10 0 GGAEMO C[N@H+]1CCCC[C@H](CNC(=O)N2CCOc3cccc(Br)c3C2)C1 ZINC000624609394 567790326 /nfs/dbraw/zinc/79/03/26/567790326.db2.gz VXRXJZDRTMJEGS-CQSZACIVSA-N 1 1 396.329 3.085 10 0 GGAEMO C[N@H+]1CCCC[C@H](CNC(=O)N2CCc3cc(F)cc(Br)c3C2)C1 ZINC000624608552 567790362 /nfs/dbraw/zinc/79/03/62/567790362.db2.gz CEMNFFVIRCEKSO-CYBMUJFWSA-N 1 1 398.320 3.388 10 0 GGAEMO O=C(Nc1cncc(Br)c1)[C@H]1CCC[N@@H+](Cc2cccnc2)C1 ZINC000533862313 567790583 /nfs/dbraw/zinc/79/05/83/567790583.db2.gz QWZBXKCHVCUUQJ-AWEZNQCLSA-N 1 1 375.270 3.090 10 0 GGAEMO C[N@H+]1CCCC[C@@H](CNC(=O)N2CCOc3cccc(Br)c3C2)C1 ZINC000624609393 567790786 /nfs/dbraw/zinc/79/07/86/567790786.db2.gz VXRXJZDRTMJEGS-AWEZNQCLSA-N 1 1 396.329 3.085 10 0 GGAEMO C[N@H+]1CCCC[C@@H](CNC(=O)N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000624616130 567791216 /nfs/dbraw/zinc/79/12/16/567791216.db2.gz RYIPKRNGCTXAHI-XJKSGUPXSA-N 1 1 396.329 3.304 10 0 GGAEMO COCC[N@H+]1CCCN(C(=O)c2c(C)cc(C)c(Br)c2C)CC1 ZINC000624620121 567791610 /nfs/dbraw/zinc/79/16/10/567791610.db2.gz VNTDMNRVENPDLI-UHFFFAOYSA-N 1 1 383.330 3.169 10 0 GGAEMO CS(=O)(=O)N1CC[C@@H](C[N@H+]2CCCCC[C@@H]2Cc2ccccc2Cl)C1 ZINC000555613294 567791588 /nfs/dbraw/zinc/79/15/88/567791588.db2.gz UJJKDDOPQBHHCF-FUHWJXTLSA-N 1 1 384.973 3.409 10 0 GGAEMO C[N@H+]1CCCC[C@@H](CNC(=O)N[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000624616124 567791740 /nfs/dbraw/zinc/79/17/40/567791740.db2.gz RYIPKRNGCTXAHI-BBRMVZONSA-N 1 1 396.329 3.304 10 0 GGAEMO Cc1cn2c([nH+]1)C[C@@H](c1nc(-c3cn4ccc(Br)cc4n3)no1)CC2 ZINC000624628598 567791753 /nfs/dbraw/zinc/79/17/53/567791753.db2.gz GBPNOXQMCLKWEG-NSHDSACASA-N 1 1 399.252 3.382 10 0 GGAEMO CC(C)Oc1cc(Br)ccc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000647630055 567793910 /nfs/dbraw/zinc/79/39/10/567793910.db2.gz ZBSMYQPIRKXRBV-HOTGVXAUSA-N 1 1 399.304 3.495 10 0 GGAEMO O=C(N1CC[C@H]([NH+]2CCC2)[C@H](F)C1)C1(c2ccc(Br)cc2)CC1 ZINC000647631385 567794044 /nfs/dbraw/zinc/79/40/44/567794044.db2.gz HWHVGFWIFNSNLY-CVEARBPZSA-N 1 1 381.289 3.125 10 0 GGAEMO O=C(Cc1c[nH]c2cccc(Br)c12)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000647633230 567794503 /nfs/dbraw/zinc/79/45/03/567794503.db2.gz VWMVJXLVDIVLIW-ZBFHGGJFSA-N 1 1 394.288 3.118 10 0 GGAEMO COc1ccc(CCC(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)cc1Br ZINC000647633599 567795147 /nfs/dbraw/zinc/79/51/47/567795147.db2.gz YRHWQZJKULMERN-CVEARBPZSA-N 1 1 399.304 3.035 10 0 GGAEMO COC(=O)c1ccc(Br)cc1C[N@@H+]1CCC[C@](CO)(C(C)C)C1 ZINC000555713088 567795612 /nfs/dbraw/zinc/79/56/12/567795612.db2.gz ZFEFDYPKDLNXIG-SFHVURJKSA-N 1 1 384.314 3.466 10 0 GGAEMO COC(=O)c1ccc(Br)cc1C[N@H+]1CCC[C@](CO)(C(C)C)C1 ZINC000555713088 567795615 /nfs/dbraw/zinc/79/56/15/567795615.db2.gz ZFEFDYPKDLNXIG-SFHVURJKSA-N 1 1 384.314 3.466 10 0 GGAEMO C[C@@H](CNC(=O)c1c(F)c(F)c(Br)c(F)c1F)[N@@H+](C)C1CC1 ZINC000668095843 567795754 /nfs/dbraw/zinc/79/57/54/567795754.db2.gz RQHKYBTZRQAZSB-LURJTMIESA-N 1 1 383.183 3.218 10 0 GGAEMO C[C@]12COC[C@@H]1C[N@@H+](Cc1cc(Br)cc(Br)c1N)C2 ZINC000668598276 567814667 /nfs/dbraw/zinc/81/46/67/567814667.db2.gz XRRAQUSITKLZHZ-HZMBPMFUSA-N 1 1 390.119 3.262 10 0 GGAEMO C[N@H+]1CC[C@@H](NC(=O)COc2cccc(Br)c2)[C@@H]1c1ccccc1 ZINC000534022055 567796941 /nfs/dbraw/zinc/79/69/41/567796941.db2.gz UVQFXKONDNNGSW-MJGOQNOKSA-N 1 1 389.293 3.390 10 0 GGAEMO O=C(NCc1ccc(Br)c(F)c1F)N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 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Cc1ccccc1[C@@H](C)NC(=O)NC[C@@H](c1cccs1)N1CC[NH+](C)CC1 ZINC000045565619 1404146328 /nfs/dbraw/zinc/14/63/28/1404146328.db2.gz FWNCRUXFARUUAN-MJGOQNOKSA-N 1 1 386.565 3.405 10 0 GGAEMO C[C@@H](CNC(=O)N1CCN(c2cccc(Cl)c2)CC1)[N@H+]1CCCC[C@@H]1C ZINC000046337978 1404369731 /nfs/dbraw/zinc/36/97/31/1404369731.db2.gz DGRZQOLBMRNKMV-IRXDYDNUSA-N 1 1 378.948 3.435 10 0 GGAEMO C[C@H]1CCC[N@@H+](CCCCNC(=O)NCc2cnn(Cc3ccccc3)c2)C1 ZINC000046751877 1404577634 /nfs/dbraw/zinc/57/76/34/1404577634.db2.gz AIQFZOPHVNTXSS-IBGZPJMESA-N 1 1 383.540 3.243 10 0 GGAEMO CCCC(=O)Nc1ccc(CNC(=O)N2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000046849155 1404609994 /nfs/dbraw/zinc/60/99/94/1404609994.db2.gz ANPWECWHPRVYPY-UHFFFAOYSA-N 1 1 394.519 3.453 10 0 GGAEMO CCCC(=O)Nc1cccc(CNC(=O)N2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000046850829 1404611240 /nfs/dbraw/zinc/61/12/40/1404611240.db2.gz DRBILYVHJBBNGF-UHFFFAOYSA-N 1 1 394.519 3.453 10 0 GGAEMO O=C(NC[C@@H]1CCN(c2ccccc2)C1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000046959176 1404653866 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/nfs/dbraw/zinc/01/33/61/1409013361.db2.gz DVTYRSDOXYPNAP-GOSISDBHSA-N 1 1 381.520 3.215 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1Cc1ccccc1CNCc1ccc(OCC(N)=O)cc1 ZINC000067120847 1409013363 /nfs/dbraw/zinc/01/33/63/1409013363.db2.gz DVTYRSDOXYPNAP-GOSISDBHSA-N 1 1 381.520 3.215 10 0 GGAEMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)c1cc(C)nc2c1nc1n2CCCCC1 ZINC000068359969 1409378084 /nfs/dbraw/zinc/37/80/84/1409378084.db2.gz ODRLRTKDZKMXML-CQSZACIVSA-N 1 1 380.496 3.037 10 0 GGAEMO O=S(=O)(NC1CC[NH+](Cc2ccncc2)CC1)c1cccc2ccccc21 ZINC000176673792 1428400072 /nfs/dbraw/zinc/40/00/72/1428400072.db2.gz JXUYUFMCOTUROR-UHFFFAOYSA-N 1 1 381.501 3.178 10 0 GGAEMO CCOC(=O)CCN(C[C@H]1CCC[N@H+]1CC)C(=O)c1ccc(SCC)nc1 ZINC000068761685 1409487589 /nfs/dbraw/zinc/48/75/89/1409487589.db2.gz ICOQXHAEGNHQGB-QGZVFWFLSA-N 1 1 393.553 3.073 10 0 GGAEMO C[C@H](C(=O)N[C@@H](C)c1cccc2ccccc21)[N@H+]1CCC[C@H](C(=O)N(C)C)C1 ZINC000068970932 1409535644 /nfs/dbraw/zinc/53/56/44/1409535644.db2.gz HTFFEVNORTWHST-SCTDSRPQSA-N 1 1 381.520 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YYAZOLFEVCVINT-OAHLLOKOSA-N 1 1 394.479 3.188 10 0 GGAEMO Cc1ccc(CN(C)C(=O)C[N@@H+]2CCC[C@@H](c3nc(-c4ccccc4)n[nH]3)C2)o1 ZINC000095993138 1410318889 /nfs/dbraw/zinc/31/88/89/1410318889.db2.gz DPYGGGLRMZMYCU-GOSISDBHSA-N 1 1 393.491 3.211 10 0 GGAEMO Cc1ccc(CN(C)C(=O)C[N@H+]2CCC[C@@H](c3nc(-c4ccccc4)n[nH]3)C2)o1 ZINC000095993138 1410318894 /nfs/dbraw/zinc/31/88/94/1410318894.db2.gz DPYGGGLRMZMYCU-GOSISDBHSA-N 1 1 393.491 3.211 10 0 GGAEMO Cc1ccc(CN(C)C(=O)C[N@@H+]2CCC[C@H](c3nc(-c4ccccc4)n[nH]3)C2)o1 ZINC000095993137 1410319158 /nfs/dbraw/zinc/31/91/58/1410319158.db2.gz DPYGGGLRMZMYCU-SFHVURJKSA-N 1 1 393.491 3.211 10 0 GGAEMO Cc1ccc(CN(C)C(=O)C[N@H+]2CCC[C@H](c3nc(-c4ccccc4)n[nH]3)C2)o1 ZINC000095993137 1410319164 /nfs/dbraw/zinc/31/91/64/1410319164.db2.gz DPYGGGLRMZMYCU-SFHVURJKSA-N 1 1 393.491 3.211 10 0 GGAEMO Cc1[nH+]ccn1CCCN(C)C(=O)[C@H]1CCn2c(cnc2-c2ccccc2)C1 ZINC000095993268 1410319549 /nfs/dbraw/zinc/31/95/49/1410319549.db2.gz PIVCAUAFCMZUEE-IBGZPJMESA-N 1 1 377.492 3.166 10 0 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375.476 3.437 10 0 GGAEMO C[C@H]([NH2+]Cc1ccc2c(c1)OCCO2)c1cc(F)ccc1N1CCN(C)CC1 ZINC000105463025 1411069011 /nfs/dbraw/zinc/06/90/11/1411069011.db2.gz ANYIDSCIKXCFMY-INIZCTEOSA-N 1 1 385.483 3.200 10 0 GGAEMO CCOCC[NH+]1CCN([C@H](C)C(=O)N[C@H](C)c2cccc3ccccc32)CC1 ZINC000106105487 1411168075 /nfs/dbraw/zinc/16/80/75/1411168075.db2.gz BLZNHHCBDSUDRF-RTBURBONSA-N 1 1 383.536 3.060 10 0 GGAEMO CCC[NH+]1CCN(C(=O)c2c(C)oc3c2CN(Cc2cccc(F)c2)CC3)CC1 ZINC000107472729 1411381010 /nfs/dbraw/zinc/38/10/10/1411381010.db2.gz WOLKYYGDHWRHKN-UHFFFAOYSA-N 1 1 399.510 3.453 10 0 GGAEMO CN(C)C(=O)[C@H]1CCC[N@H+]1CCCNC(=O)CC1CCC(c2ccccc2)CC1 ZINC000108264781 1411462306 /nfs/dbraw/zinc/46/23/06/1411462306.db2.gz HTISKTTUOOAXDU-KITAHSCOSA-N 1 1 399.579 3.409 10 0 GGAEMO COC(=O)Nc1ccc(C[NH2+]Cc2c(C)nn(C)c2OCC(F)(F)F)cc1 ZINC000109068901 1411675035 /nfs/dbraw/zinc/67/50/35/1411675035.db2.gz AUXRMMQZXNHULA-UHFFFAOYSA-N 1 1 386.374 3.138 10 0 GGAEMO COC(=O)N[C@@H](CC(C)C)C(=O)N1CC[NH+](Cc2cccc3ccccc32)CC1 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383.492 3.156 10 0 GGAEMO NC(=O)[C@H]1CCC[N@H+]1Cc1cccc(NCc2csc(-c3ccccn3)n2)c1 ZINC000120072883 1413675971 /nfs/dbraw/zinc/67/59/71/1413675971.db2.gz FNJWMCCIGNWMBX-LJQANCHMSA-N 1 1 393.516 3.267 10 0 GGAEMO CC(C)(C)OC(=O)NCC[N@@H+]1CCCN(C(=O)c2ccc(Cl)cc2)CC1 ZINC000177460394 1428746006 /nfs/dbraw/zinc/74/60/06/1428746006.db2.gz REEQLWJJDHOCPU-UHFFFAOYSA-N 1 1 381.904 3.013 10 0 GGAEMO CC(C)(C)OC(=O)NCC[N@H+]1CCCN(C(=O)c2ccc(Cl)cc2)CC1 ZINC000177460394 1428746009 /nfs/dbraw/zinc/74/60/09/1428746009.db2.gz REEQLWJJDHOCPU-UHFFFAOYSA-N 1 1 381.904 3.013 10 0 GGAEMO NC(=O)[C@@H]1CCC[N@H+]1Cc1cccc(NCc2csc(-c3ccccn3)n2)c1 ZINC000120073026 1413676729 /nfs/dbraw/zinc/67/67/29/1413676729.db2.gz FNJWMCCIGNWMBX-IBGZPJMESA-N 1 1 393.516 3.267 10 0 GGAEMO Cc1nn(-c2ccccc2)cc1CNc1cccc(C[N@H+]2CCC[C@H]2C(N)=O)c1 ZINC000120110630 1413691820 /nfs/dbraw/zinc/69/18/20/1413691820.db2.gz BHCIDRNUXUCKHV-QFIPXVFZSA-N 1 1 389.503 3.243 10 0 GGAEMO COc1cc2c(c(CNc3cccc(C[N@H+]4CCC[C@@H]4C(N)=O)c3)c1)O[C@H](C)C2 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ZINC000124793109 1415044794 /nfs/dbraw/zinc/04/47/94/1415044794.db2.gz BAUYAWPUDYZHDL-WZGPROSRSA-N 1 1 397.485 3.476 10 0 GGAEMO COC(=O)Nc1ccc(CNC(=O)N[C@@H]2C[C@H](C)[N@@H+](Cc3ccccc3)C2)cc1 ZINC000125103924 1415109490 /nfs/dbraw/zinc/10/94/90/1415109490.db2.gz DYKNOFKXBNPXPC-OXJNMPFZSA-N 1 1 396.491 3.327 10 0 GGAEMO COC(=O)Nc1ccc(CNC(=O)N[C@H]2C[C@@H](C)[N@@H+](Cc3ccccc3)C2)cc1 ZINC000125103403 1415109579 /nfs/dbraw/zinc/10/95/79/1415109579.db2.gz DYKNOFKXBNPXPC-UZLBHIALSA-N 1 1 396.491 3.327 10 0 GGAEMO COc1ccc(CNc2ccc3c(c2)[nH+]c(C(C)(C)C)n3C)cc1OCC(N)=O ZINC000125248035 1415141123 /nfs/dbraw/zinc/14/11/23/1415141123.db2.gz AORCYGZZPATGRS-UHFFFAOYSA-N 1 1 396.491 3.356 10 0 GGAEMO Cn1cc(C[N@H+]2CCC[C@@H]2CN2CCOCC2)c(-c2cc3ccccc3o2)n1 ZINC000125703759 1415257961 /nfs/dbraw/zinc/25/79/61/1415257961.db2.gz AKTCTYZMKAIKCH-LJQANCHMSA-N 1 1 380.492 3.130 10 0 GGAEMO Oc1ccc(Br)c(C[NH2+]C[C@H]2CN(Cc3ccccc3)CCO2)c1 ZINC000126258336 1415396440 /nfs/dbraw/zinc/39/64/40/1415396440.db2.gz DJMDVSNBPLUNCD-SFHVURJKSA-N 1 1 391.309 3.145 10 0 GGAEMO COc1cccc([C@H](C)[NH+]2CCN(Cc3nc4oc(C)c(C)c4c(N)n3)CC2)c1 ZINC000178014269 1428935674 /nfs/dbraw/zinc/93/56/74/1428935674.db2.gz DUEVSIWJHZRTKS-HNNXBMFYSA-N 1 1 395.507 3.309 10 0 GGAEMO Cc1ccc(-c2ncc(CNCc3cccc(C(=O)NCC[NH+](C)C)c3)s2)o1 ZINC000126792891 1415560953 /nfs/dbraw/zinc/56/09/53/1415560953.db2.gz CSELBCDVSRDYDS-UHFFFAOYSA-N 1 1 398.532 3.293 10 0 GGAEMO NC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(NCc3c(Cl)nc4ccccn43)cc2)C1 ZINC000127440687 1415779717 /nfs/dbraw/zinc/77/97/17/1415779717.db2.gz APDXIACNHMZWLW-MRXNPFEDSA-N 1 1 397.910 3.297 10 0 GGAEMO Cc1c(C(=O)N2CCN(c3ccc(Cl)cc3)CC2)cnn1-c1cc[nH+]cc1 ZINC000128090563 1415910372 /nfs/dbraw/zinc/91/03/72/1415910372.db2.gz DXOYADGMHYFFRK-UHFFFAOYSA-N 1 1 381.867 3.192 10 0 GGAEMO Cc1c(C)n(Cc2ccco2)c2nc[nH+]c(NCc3cccc(C(N)=O)c3)c12 ZINC000128242480 1415946841 /nfs/dbraw/zinc/94/68/41/1415946841.db2.gz AUUMLQBUSCDLGN-UHFFFAOYSA-N 1 1 375.432 3.400 10 0 GGAEMO Cc1nn(C)c(OCC(F)(F)F)c1C[N@@H+]1CC[C@H](CNc2cccc(C)n2)C1 ZINC000128285202 1415954834 /nfs/dbraw/zinc/95/48/34/1415954834.db2.gz STNUIPXGIPHKOI-OAHLLOKOSA-N 1 1 397.445 3.307 10 0 GGAEMO Cc1nn(C)c(OCC(F)(F)F)c1C[N@H+]1CC[C@H](CNc2cccc(C)n2)C1 ZINC000128285202 1415954837 /nfs/dbraw/zinc/95/48/37/1415954837.db2.gz STNUIPXGIPHKOI-OAHLLOKOSA-N 1 1 397.445 3.307 10 0 GGAEMO CC[N@@H+](Cc1cnc(N2CCOCC2)s1)[C@@H](C)Cc1ccc(OC)cc1 ZINC000128406520 1415980600 /nfs/dbraw/zinc/98/06/00/1415980600.db2.gz YHZKWKJMEGXGGB-INIZCTEOSA-N 1 1 375.538 3.441 10 0 GGAEMO CNC(=O)c1cccc(C[N@@H+](C)CC[C@@H](NC(=O)OC(C)(C)C)C(C)C)c1 ZINC000178468197 1429084423 /nfs/dbraw/zinc/08/44/23/1429084423.db2.gz AZYBXAIAVWMOGD-GOSISDBHSA-N 1 1 377.529 3.417 10 0 GGAEMO C[C@H](c1ccc(NC(=O)N2CC[C@H](C)[C@H](n3ccnc3)C2)cc1)[NH+]1CCOCC1 ZINC000130114979 1416320462 /nfs/dbraw/zinc/32/04/62/1416320462.db2.gz CCDJANILKIIOEK-WAOWUJCRSA-N 1 1 397.523 3.391 10 0 GGAEMO CSCC[C@H]([NH2+]Cc1ccc(N2CCCC2)nc1)c1nnc2ccccn21 ZINC000130822294 1416459736 /nfs/dbraw/zinc/45/97/36/1416459736.db2.gz BBJKGBREWAMAJI-KRWDZBQOSA-N 1 1 382.537 3.309 10 0 GGAEMO COc1cc(OC)c(OC)cc1CNC1CC[NH+]([C@H](C)c2ccncc2)CC1 ZINC000131077519 1416505229 /nfs/dbraw/zinc/50/52/29/1416505229.db2.gz BFFIAQYLWLAGID-MRXNPFEDSA-N 1 1 385.508 3.423 10 0 GGAEMO COc1ccc(CNc2ccc(NC(=O)C[NH+](C)C)cc2)cc1OC(F)F ZINC000132035793 1416679685 /nfs/dbraw/zinc/67/96/85/1416679685.db2.gz DSFLYZJELJAWRQ-UHFFFAOYSA-N 1 1 379.407 3.409 10 0 GGAEMO COc1cc(C(=O)N2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc(OC)c1OC ZINC000135132063 1417175696 /nfs/dbraw/zinc/17/56/96/1417175696.db2.gz HFYVASSORLWJFB-INIZCTEOSA-N 1 1 384.476 3.059 10 0 GGAEMO COc1cc(C(=O)N2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)cc(OC)c1OC ZINC000135132063 1417175702 /nfs/dbraw/zinc/17/57/02/1417175702.db2.gz HFYVASSORLWJFB-INIZCTEOSA-N 1 1 384.476 3.059 10 0 GGAEMO C[C@H]1C[N@H+](Cc2ccccc2)CCN1C(=O)Cc1csc(-c2cccnc2)n1 ZINC000135134277 1417176338 /nfs/dbraw/zinc/17/63/38/1417176338.db2.gz DXJMXEWINZQSNX-KRWDZBQOSA-N 1 1 392.528 3.481 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)Cc1csc(-c2cccnc2)n1 ZINC000135134277 1417176345 /nfs/dbraw/zinc/17/63/45/1417176345.db2.gz DXJMXEWINZQSNX-KRWDZBQOSA-N 1 1 392.528 3.481 10 0 GGAEMO Cc1cc(C)n(-c2ccc(C(=O)N3CC[N@@H+](Cc4ccccc4)C[C@@H]3C)cn2)n1 ZINC000135133617 1417176416 /nfs/dbraw/zinc/17/64/16/1417176416.db2.gz CYJWGHVNWGYQCK-IBGZPJMESA-N 1 1 389.503 3.231 10 0 GGAEMO Cc1cc(C)n(-c2ccc(C(=O)N3CC[N@H+](Cc4ccccc4)C[C@@H]3C)cn2)n1 ZINC000135133617 1417176419 /nfs/dbraw/zinc/17/64/19/1417176419.db2.gz CYJWGHVNWGYQCK-IBGZPJMESA-N 1 1 389.503 3.231 10 0 GGAEMO O[C@@H]1CCCC[C@H]1[NH+]1CCC(NCc2ccc(OCC(F)(F)F)cc2)CC1 ZINC000136592050 1417330733 /nfs/dbraw/zinc/33/07/33/1417330733.db2.gz HYZDGEDBUMTMAM-RTBURBONSA-N 1 1 386.458 3.485 10 0 GGAEMO C[N@H+]1CCC[C@H]2CN(C(=O)NCc3ccc(OCc4ccccn4)cc3)CC[C@@H]21 ZINC000137145914 1417370867 /nfs/dbraw/zinc/37/08/67/1417370867.db2.gz GBHYGANVHTYUBP-UGKGYDQZSA-N 1 1 394.519 3.286 10 0 GGAEMO C[N@H+]1CCC[C@@H]2CN(C(=O)NCc3ccc(OCc4ccccn4)cc3)CC[C@@H]21 ZINC000137145961 1417371006 /nfs/dbraw/zinc/37/10/06/1417371006.db2.gz GBHYGANVHTYUBP-KNQAVFIVSA-N 1 1 394.519 3.286 10 0 GGAEMO Cc1nn(C)c(OCC(F)(F)F)c1CN[C@H]1C[C@@H](C)[N@H+](Cc2ccccc2)C1 ZINC000151322918 1417926178 /nfs/dbraw/zinc/92/61/78/1417926178.db2.gz FSJVXRVQCZNRNW-PBHICJAKSA-N 1 1 396.457 3.422 10 0 GGAEMO Cc1nn(C)c(OCC(F)(F)F)c1C[NH2+][C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000151322918 1417926182 /nfs/dbraw/zinc/92/61/82/1417926182.db2.gz FSJVXRVQCZNRNW-PBHICJAKSA-N 1 1 396.457 3.422 10 0 GGAEMO C[NH+]1CCN(C(=O)c2ccc(NC(=O)[C@@H]3C[C@@H]3c3cccc(F)c3F)cc2)CC1 ZINC000152187086 1418168750 /nfs/dbraw/zinc/16/87/50/1418168750.db2.gz BVQDMRCCHNFODO-QZTJIDSGSA-N 1 1 399.441 3.095 10 0 GGAEMO COc1cccc(C[NH+]2CCN(c3ccc(C(F)(F)F)cn3)CC2)c1OC ZINC000179655566 1429492367 /nfs/dbraw/zinc/49/23/67/1429492367.db2.gz GCPBZGBQMLXHND-UHFFFAOYSA-N 1 1 381.398 3.440 10 0 GGAEMO Cc1onc(-c2ccccn2)c1C(=O)NC1CCN(c2cccc(C)[nH+]2)CC1 ZINC000152338792 1422076818 /nfs/dbraw/zinc/07/68/18/1422076818.db2.gz ZAQMBVVFFYSNMR-UHFFFAOYSA-N 1 1 377.448 3.147 10 0 GGAEMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)CCCCNC(=O)OC(C)(C)C ZINC000152716603 1422221455 /nfs/dbraw/zinc/22/14/55/1422221455.db2.gz HCZDMGURWWRJEI-MJGOQNOKSA-N 1 1 389.540 3.318 10 0 GGAEMO C[C@H](C(=O)N1c2ccccc2CC[C@H]1C)[NH+]1CCC(N2CCCCC2=O)CC1 ZINC000153097892 1422355328 /nfs/dbraw/zinc/35/53/28/1422355328.db2.gz FCKOZWSYJJEBSR-QZTJIDSGSA-N 1 1 383.536 3.220 10 0 GGAEMO CC[C@H](C)[N@@H+](C)CCNC(=O)C(=O)Nc1cc(-c2ccccc2)nn1C(C)(C)C ZINC000153141639 1422370150 /nfs/dbraw/zinc/37/01/50/1422370150.db2.gz FCNYXNRAPTWCIZ-INIZCTEOSA-N 1 1 399.539 3.090 10 0 GGAEMO NC(=O)[C@@H]1CCC[N@@H+](Cc2ccc(NCc3ncccc3C(F)(F)F)cc2)C1 ZINC000153289100 1422443845 /nfs/dbraw/zinc/44/38/45/1422443845.db2.gz AEICGSPANZYIPY-OAHLLOKOSA-N 1 1 392.425 3.410 10 0 GGAEMO NC(=O)[C@H]1CCC[N@@H+](Cc2ccc(NCc3ncccc3C(F)(F)F)cc2)C1 ZINC000153289015 1422444581 /nfs/dbraw/zinc/44/45/81/1422444581.db2.gz AEICGSPANZYIPY-HNNXBMFYSA-N 1 1 392.425 3.410 10 0 GGAEMO CCC[N@@H+](CC)CCNC(=O)C(=O)Nc1cc(-c2ccccc2)nn1C(C)(C)C ZINC000154074717 1422836151 /nfs/dbraw/zinc/83/61/51/1422836151.db2.gz BPQBABUAZBGWNM-UHFFFAOYSA-N 1 1 399.539 3.092 10 0 GGAEMO C[C@H]1CCN(C(=O)N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)C[C@@H]1n1ccnc1 ZINC000154298957 1422869130 /nfs/dbraw/zinc/86/91/30/1422869130.db2.gz BJTYYFOSDPGHJC-MPJJRAAHSA-N 1 1 395.551 3.386 10 0 GGAEMO CC(C)(C)OC(=O)N[C@H]1CCC[N@@H+](Cc2ccccc2N2CCOCC2)C1 ZINC000154904724 1423075272 /nfs/dbraw/zinc/07/52/72/1423075272.db2.gz RHBHQTIXQYTHGT-SFHVURJKSA-N 1 1 375.513 3.012 10 0 GGAEMO C[C@H](NCCC[N@@H+]1CCC[C@@H]1C(=O)N(C)C)c1ccccc1OC(F)(F)F ZINC000155286642 1423301653 /nfs/dbraw/zinc/30/16/53/1423301653.db2.gz IDTGQMNSLKVTAV-GOEBONIOSA-N 1 1 387.446 3.179 10 0 GGAEMO C[C@H](NCCC[N@H+]1CCC[C@@H]1C(=O)N(C)C)c1ccccc1OC(F)(F)F ZINC000155286642 1423301663 /nfs/dbraw/zinc/30/16/63/1423301663.db2.gz IDTGQMNSLKVTAV-GOEBONIOSA-N 1 1 387.446 3.179 10 0 GGAEMO COc1ccc([C@@H]2CC[N@@H+](CC(=O)N(C)Cc3ccc(OC)c(OC)c3)C2)cc1 ZINC000155321010 1423316089 /nfs/dbraw/zinc/31/60/89/1423316089.db2.gz GAXNOGLFRKQSFK-LJQANCHMSA-N 1 1 398.503 3.160 10 0 GGAEMO CC(C)[C@@H](NC(=O)C[N@@H+](C)CC1CCOCC1)c1ccc2c(c1)OCCCO2 ZINC000156143865 1423691945 /nfs/dbraw/zinc/69/19/45/1423691945.db2.gz DRTVQEYHLJYHPW-JOCHJYFZSA-N 1 1 390.524 3.020 10 0 GGAEMO CC(C)[C@H](NC(=O)C[N@@H+](C)CC1CCOCC1)c1ccc2c(c1)OCCCO2 ZINC000156143743 1423692085 /nfs/dbraw/zinc/69/20/85/1423692085.db2.gz DRTVQEYHLJYHPW-QFIPXVFZSA-N 1 1 390.524 3.020 10 0 GGAEMO C[C@H]1CC[N@@H+](CC(=O)N2CCC(Cc3ccccc3)CC2)C[C@@H]1n1ccnc1 ZINC000156511564 1423821017 /nfs/dbraw/zinc/82/10/17/1423821017.db2.gz BOQYGGIQNOBAEJ-UGKGYDQZSA-N 1 1 380.536 3.247 10 0 GGAEMO C[NH+]1CCN(C(=O)Cc2ccc(NCc3ccc(F)cc3Cl)cc2)CC1 ZINC000157121868 1423931039 /nfs/dbraw/zinc/93/10/39/1423931039.db2.gz DQTUWKVASVMVEQ-UHFFFAOYSA-N 1 1 375.875 3.408 10 0 GGAEMO CCCOc1ccc(CNC(=O)NC[C@H]2CC[N@@H+](CC(C)C)C2)cc1OC ZINC000157269493 1423970934 /nfs/dbraw/zinc/97/09/34/1423970934.db2.gz CFGBRJUOWIMWCX-GOSISDBHSA-N 1 1 377.529 3.261 10 0 GGAEMO C[NH+](C)CCNC(=O)c1cccc(CNCc2cc(Cl)cc3cccnc32)c1 ZINC000157577027 1424042202 /nfs/dbraw/zinc/04/22/02/1424042202.db2.gz CAINTNSWFLMDAS-UHFFFAOYSA-N 1 1 396.922 3.469 10 0 GGAEMO Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)[N@H+](C)CCc1nccs1 ZINC000157883477 1424111977 /nfs/dbraw/zinc/11/19/77/1424111977.db2.gz BFKVBIFDFLQHLW-INIZCTEOSA-N 1 1 383.521 3.447 10 0 GGAEMO Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)[N@@H+](C)CCc1nccs1 ZINC000157883477 1424111980 /nfs/dbraw/zinc/11/19/80/1424111980.db2.gz BFKVBIFDFLQHLW-INIZCTEOSA-N 1 1 383.521 3.447 10 0 GGAEMO C[C@@H]1CC(=O)CC[C@@H]1C(=O)N[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000158464018 1424264258 /nfs/dbraw/zinc/26/42/58/1424264258.db2.gz ACWBUDGLHDVNOQ-QBIMZIAESA-N 1 1 382.426 3.401 10 0 GGAEMO C[C@@H]1CC(=O)CC[C@@H]1C(=O)N[C@@H]1CC[N@@H+](Cc2ccc(C(F)(F)F)cc2)C1 ZINC000158464018 1424264268 /nfs/dbraw/zinc/26/42/68/1424264268.db2.gz ACWBUDGLHDVNOQ-QBIMZIAESA-N 1 1 382.426 3.401 10 0 GGAEMO CC(C)(C)OC(=O)N1CCc2cccc(C[NH+]3CCN(c4ncccn4)CC3)c21 ZINC000158817285 1424349278 /nfs/dbraw/zinc/34/92/78/1424349278.db2.gz WPUMYUMIGCVFGJ-UHFFFAOYSA-N 1 1 395.507 3.096 10 0 GGAEMO O=C(Nc1ccccc1C[NH+]1CCSCC1)N[C@@H]1c2ccccc2C[C@H]1O ZINC000158821763 1424350351 /nfs/dbraw/zinc/35/03/51/1424350351.db2.gz BXLICDGJQDEDCQ-WOJBJXKFSA-N 1 1 383.517 3.015 10 0 GGAEMO C[C@H]1CC[N@@H+](CC(=O)N(C)Cc2ccc(OC(F)F)cc2)C[C@@H]1n1ccnc1 ZINC000159018727 1424397224 /nfs/dbraw/zinc/39/72/24/1424397224.db2.gz GDDIUKQFKOCAKR-YJBOKZPZSA-N 1 1 392.450 3.026 10 0 GGAEMO CC[N@@H+](C[C@@H](O)c1ccc(C)cc1)[C@@H](C)C(=O)Nc1cc(C(=O)OC)ccc1C ZINC000159950614 1424555678 /nfs/dbraw/zinc/55/56/78/1424555678.db2.gz FKSJMMHXLWXAPQ-LAUBAEHRSA-N 1 1 398.503 3.473 10 0 GGAEMO CCN(C[C@@H]1CC[N@@H+](Cc2ccccc2)C1)C(=O)Nc1cn(C)c(=O)cc1C ZINC000162599651 1424870451 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CC[N@@H+](CCc1nccs1)[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O ZINC000189752367 1432223726 /nfs/dbraw/zinc/22/37/26/1432223726.db2.gz DSBGTSLQAPLKAO-KRWDZBQOSA-N 1 1 379.476 3.477 10 0 GGAEMO C[C@H](NC(=O)[C@H](C)N1CC[N@@H+](CC(C)(C)O)[C@@H](C)C1)c1cccc2ccccc21 ZINC000189879476 1432260562 /nfs/dbraw/zinc/26/05/62/1432260562.db2.gz HOYKAFANLVXRFT-FHWLQOOXSA-N 1 1 397.563 3.183 10 0 GGAEMO C[C@@H](Cc1ccccc1F)NC(=O)N(C)C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1 ZINC000190397175 1432373497 /nfs/dbraw/zinc/37/34/97/1432373497.db2.gz HCIGDPKHGMRLKA-MBSDFSHPSA-N 1 1 399.510 3.035 10 0 GGAEMO COc1cc(S(=O)(=O)N[C@H]2CC[N@@H+](Cc3ccccc3)[C@H](C)C2)ccc1F ZINC000190759853 1432469968 /nfs/dbraw/zinc/46/99/68/1432469968.db2.gz XPQVKOPZSOVKFU-WBVHZDCISA-N 1 1 392.496 3.166 10 0 GGAEMO COCCOc1cc(OC)ccc1C(=O)N1CC[N@H+](Cc2ccccc2)C[C@@H]1C ZINC000191146774 1432576215 /nfs/dbraw/zinc/57/62/15/1432576215.db2.gz CYZBYZPUGSOKJF-SFHVURJKSA-N 1 1 398.503 3.067 10 0 GGAEMO COCCOc1cc(OC)ccc1C(=O)N1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000191146774 1432576222 /nfs/dbraw/zinc/57/62/22/1432576222.db2.gz CYZBYZPUGSOKJF-SFHVURJKSA-N 1 1 398.503 3.067 10 0 GGAEMO FC(F)n1ccnc1CN1CC[NH+](Cc2ccc(OCC3CC3)cc2)CC1 ZINC000191283355 1432620597 /nfs/dbraw/zinc/62/05/97/1432620597.db2.gz PDEFEKFYWZWHOG-UHFFFAOYSA-N 1 1 376.451 3.385 10 0 GGAEMO C[N@H+](CC(=O)OC(C)(C)C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000191800676 1432728309 /nfs/dbraw/zinc/72/83/09/1432728309.db2.gz JQQIIWJKTWGQJU-UHFFFAOYSA-N 1 1 385.411 3.115 10 0 GGAEMO C[N@@H+](CC(=O)OC(C)(C)C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC000191800676 1432728313 /nfs/dbraw/zinc/72/83/13/1432728313.db2.gz JQQIIWJKTWGQJU-UHFFFAOYSA-N 1 1 385.411 3.115 10 0 GGAEMO C[N@@H+]1C[C@H]2CN(C(=O)[C@H]3C[C@H]3c3ccc(OCc4ccccc4)cc3)C[C@H]2C1 ZINC000192478473 1432849366 /nfs/dbraw/zinc/84/93/66/1432849366.db2.gz DVZWCOPYIZYKDE-MQFRRQCYSA-N 1 1 376.500 3.389 10 0 GGAEMO COc1ccccc1[C@H](C)NC(=O)[C@H](C)[N@H+](C)C[C@@H]1COc2ccccc2O1 ZINC000192513080 1432853463 /nfs/dbraw/zinc/85/34/63/1432853463.db2.gz GXWOPUQRHVGCQF-YESZJQIVSA-N 1 1 384.476 3.033 10 0 GGAEMO COc1ccccc1[C@H](C)NC(=O)[C@H](C)[N@@H+](C)C[C@@H]1COc2ccccc2O1 ZINC000192513080 1432853464 /nfs/dbraw/zinc/85/34/64/1432853464.db2.gz GXWOPUQRHVGCQF-YESZJQIVSA-N 1 1 384.476 3.033 10 0 GGAEMO COc1ccccc1[C@H](C)NC(=O)[C@@H](C)[N@H+](C)C[C@@H]1COc2ccccc2O1 ZINC000192513056 1432853479 /nfs/dbraw/zinc/85/34/79/1432853479.db2.gz GXWOPUQRHVGCQF-GVDBMIGSSA-N 1 1 384.476 3.033 10 0 GGAEMO COc1ccccc1[C@H](C)NC(=O)[C@@H](C)[N@@H+](C)C[C@@H]1COc2ccccc2O1 ZINC000192513056 1432853480 /nfs/dbraw/zinc/85/34/80/1432853480.db2.gz GXWOPUQRHVGCQF-GVDBMIGSSA-N 1 1 384.476 3.033 10 0 GGAEMO Cc1noc(C2CC[NH+]([C@H](C)C(=O)N[C@@H](C)c3ccc(Cl)cc3)CC2)n1 ZINC000193542917 1433017117 /nfs/dbraw/zinc/01/71/17/1433017117.db2.gz HATSTEFQTKVNKO-QWHCGFSZSA-N 1 1 376.888 3.477 10 0 GGAEMO Cc1noc(C2CC[NH+]([C@@H](C)C(=O)N[C@H](C)c3ccc(Cl)cc3)CC2)n1 ZINC000193542931 1433017135 /nfs/dbraw/zinc/01/71/35/1433017135.db2.gz HATSTEFQTKVNKO-OLZOCXBDSA-N 1 1 376.888 3.477 10 0 GGAEMO CNC(=O)c1cccc(NC(=O)[C@@H](C)SCC[N@@H+](C)Cc2ccccc2)c1 ZINC000193626538 1433030631 /nfs/dbraw/zinc/03/06/31/1433030631.db2.gz GPJMSZJTGIUTPS-MRXNPFEDSA-N 1 1 385.533 3.238 10 0 GGAEMO COc1cccc([C@H](O)C[N@H+]2CCC23CCN(C(=O)OC(C)(C)C)CC3)c1 ZINC000193749770 1433051746 /nfs/dbraw/zinc/05/17/46/1433051746.db2.gz KAZBIQQLDZSGTE-GOSISDBHSA-N 1 1 376.497 3.204 10 0 GGAEMO CC(C)(C)OC(=O)N1CCC2(CC[N@H+]2C[C@@H](O)COCc2ccccc2)CC1 ZINC000193751354 1433052236 /nfs/dbraw/zinc/05/22/36/1433052236.db2.gz BMQXUHRYQSOSNX-LJQANCHMSA-N 1 1 390.524 3.040 10 0 GGAEMO Cc1ccc(OC[C@H](O)C[N@H+]2CCC23CCN(C(=O)OC(C)(C)C)CC3)cc1 ZINC000193752107 1433052440 /nfs/dbraw/zinc/05/24/40/1433052440.db2.gz LITUISLHQCCPQO-GOSISDBHSA-N 1 1 390.524 3.210 10 0 GGAEMO O=C(NC[C@@H](c1ccccc1)[N@@H+]1CCc2sccc2C1)[C@H]1CCCCC(=O)N1 ZINC000193829932 1433068484 /nfs/dbraw/zinc/06/84/84/1433068484.db2.gz ADYBGOWBGNGVOY-MOPGFXCFSA-N 1 1 397.544 3.023 10 0 GGAEMO O=C(NC[C@@H](c1ccccc1)[N@H+]1CCc2sccc2C1)[C@H]1CCCCC(=O)N1 ZINC000193829932 1433068486 /nfs/dbraw/zinc/06/84/86/1433068486.db2.gz ADYBGOWBGNGVOY-MOPGFXCFSA-N 1 1 397.544 3.023 10 0 GGAEMO O=C(NC[C@H](c1ccccc1)[N@@H+]1CCc2sccc2C1)[C@H]1CCCCC(=O)N1 ZINC000193829913 1433068494 /nfs/dbraw/zinc/06/84/94/1433068494.db2.gz ADYBGOWBGNGVOY-RTBURBONSA-N 1 1 397.544 3.023 10 0 GGAEMO O=C(NC[C@H](c1ccccc1)[N@H+]1CCc2sccc2C1)[C@H]1CCCCC(=O)N1 ZINC000193829913 1433068500 /nfs/dbraw/zinc/06/85/00/1433068500.db2.gz ADYBGOWBGNGVOY-RTBURBONSA-N 1 1 397.544 3.023 10 0 GGAEMO Cc1[nH]ncc1C(=O)Nc1ccc(N2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000194022214 1433102317 /nfs/dbraw/zinc/10/23/17/1433102317.db2.gz ZGDZLGUDZZMXIB-UHFFFAOYSA-N 1 1 375.476 3.293 10 0 GGAEMO CC(=O)Nc1cccc(NC(=O)[C@@H](C)[NH+]2CCC(OCCC(C)C)CC2)c1 ZINC000194340555 1433164191 /nfs/dbraw/zinc/16/41/91/1433164191.db2.gz ADOAGKFJMFVFRK-MRXNPFEDSA-N 1 1 375.513 3.499 10 0 GGAEMO CCOc1cc2c(cc1C[NH2+]Cc1ccc(S(C)(=O)=O)cc1)O[C@H](C)C2 ZINC000236845371 1433380981 /nfs/dbraw/zinc/38/09/81/1433380981.db2.gz ICVMESPEYXLKIH-CQSZACIVSA-N 1 1 375.490 3.102 10 0 GGAEMO CCN1CCN(C[C@H](C)C[NH2+]Cc2cccc(OCc3ccccn3)c2)CC1 ZINC000236953826 1433384050 /nfs/dbraw/zinc/38/40/50/1433384050.db2.gz GKMQNZMBTGDSGH-HXUWFJFHSA-N 1 1 382.552 3.024 10 0 GGAEMO CN1CCN(c2ccc(C[NH2+]Cc3cccc(OC(F)(F)F)c3)cn2)CC1 ZINC000237035162 1433386511 /nfs/dbraw/zinc/38/65/11/1433386511.db2.gz HFXKRFQFAARNBU-UHFFFAOYSA-N 1 1 380.414 3.022 10 0 GGAEMO COc1ccc(Br)c(C[NH2+][C@@H]2CCN(c3ccccc3F)C2=O)c1 ZINC000237422771 1433402539 /nfs/dbraw/zinc/40/25/39/1433402539.db2.gz BSWKZUFZHQXHNN-MRXNPFEDSA-N 1 1 393.256 3.492 10 0 GGAEMO Cc1nn(C)c(OCC(F)(F)F)c1CNCC(C)(C)[N@H+]1CCC[C@H](C)C1 ZINC000237718795 1433419007 /nfs/dbraw/zinc/41/90/07/1433419007.db2.gz BZRLVMROKVPEFO-ZDUSSCGKSA-N 1 1 376.467 3.270 10 0 GGAEMO Cc1nn(C)c(OCC(F)(F)F)c1C[NH2+]Cc1ccc(N2CCCC2=O)cc1 ZINC000237768532 1433422254 /nfs/dbraw/zinc/42/22/54/1433422254.db2.gz DVXXTWGUTKLPRB-UHFFFAOYSA-N 1 1 396.413 3.086 10 0 GGAEMO CC[N@@H+](C)C[C@H]1CCN([C@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000245439093 1433467871 /nfs/dbraw/zinc/46/78/71/1433467871.db2.gz FQNGEFVBXOIQAR-RTBURBONSA-N 1 1 383.540 3.090 10 0 GGAEMO CN(C(=O)[C@@H]1COc2ccccc2C1)[C@H]1CCCC[C@H]1[N@@H+](C)C1CCN(C)CC1 ZINC000245627447 1433492626 /nfs/dbraw/zinc/49/26/26/1433492626.db2.gz CNDONKNTIJRKCS-NNWRFLSQSA-N 1 1 399.579 3.033 10 0 GGAEMO CN(Cc1ccccc1)C(=O)CN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1 ZINC000245744698 1433509730 /nfs/dbraw/zinc/50/97/30/1433509730.db2.gz SJSXNMRNYUJXTL-NUNAXRQHSA-N 1 1 377.532 3.430 10 0 GGAEMO CC[N@@H+](C[C@@H](O)c1ccc(C)cc1)[C@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000245749443 1433510786 /nfs/dbraw/zinc/51/07/86/1433510786.db2.gz GLWJAGSIMXZXJA-IIBYNOLFSA-N 1 1 383.492 3.336 10 0 GGAEMO O=C(CC[NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)NCc1ccccc1 ZINC000245769935 1433514780 /nfs/dbraw/zinc/51/47/80/1433514780.db2.gz XAZYJTRDOALTOW-NUNAXRQHSA-N 1 1 377.532 3.478 10 0 GGAEMO CCC[C@H]1CN(C(=O)N[C@H](C)c2ccc(-n3cccn3)cc2)CC[N@H+]1CCOC ZINC000245857862 1433528231 /nfs/dbraw/zinc/52/82/31/1433528231.db2.gz DXEJHXYWLWVAEY-NQIIRXRSSA-N 1 1 399.539 3.076 10 0 GGAEMO CCOC(=O)[C@@H]1CCCN(C(=O)[C@H](C)[NH2+][C@H](C)c2ccc(F)cc2Cl)C1 ZINC000245977836 1433553080 /nfs/dbraw/zinc/55/30/80/1433553080.db2.gz ALFZMNOCCLLECY-HZSPNIEDSA-N 1 1 384.879 3.320 10 0 GGAEMO CC(=O)N1CC[C@H](C[N@H+](C)[C@@H](C)C(=O)N[C@@H](C)c2cccc3ccccc32)C1 ZINC000246036183 1433560332 /nfs/dbraw/zinc/56/03/32/1433560332.db2.gz AEIZZZFQFIYQBX-JENIJYKNSA-N 1 1 381.520 3.206 10 0 GGAEMO Cc1cc(NC(=O)C[N@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)n(-c2ccc(C)cc2)n1 ZINC000247364645 1433713311 /nfs/dbraw/zinc/71/33/11/1433713311.db2.gz HLDAPJUALJEYCD-PXNSSMCTSA-N 1 1 392.507 3.207 10 0 GGAEMO Cc1cc(NC(=O)C[N@@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)n(-c2ccc(C)cc2)n1 ZINC000247364645 1433713315 /nfs/dbraw/zinc/71/33/15/1433713315.db2.gz HLDAPJUALJEYCD-PXNSSMCTSA-N 1 1 392.507 3.207 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCCNC(=O)[C@@H]1CCC[C@@H](NC(=O)OC(C)(C)C)C1 ZINC000247488975 1433728771 /nfs/dbraw/zinc/72/87/71/1433728771.db2.gz UCZXTGSZVXORKY-KZNAEPCWSA-N 1 1 381.561 3.451 10 0 GGAEMO CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](C[C@@H](O)c3ccc(F)c(F)c3)C[C@H]12 ZINC000248593608 1433810261 /nfs/dbraw/zinc/81/02/61/1433810261.db2.gz LSTMNBJZYBNANX-LTCOOKNTSA-N 1 1 382.451 3.233 10 0 GGAEMO COC(=O)c1ccc(C[N@H+]2C[C@@H]3CC[C@H](NC(=O)OC(C)(C)C)[C@@H]3C2)cc1F ZINC000248614601 1433811541 /nfs/dbraw/zinc/81/15/41/1433811541.db2.gz RGUYATHVHRIYPM-LESCRADOSA-N 1 1 392.471 3.347 10 0 GGAEMO CC(C)(C)OC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](Cc3cc(F)cc4c3OCOC4)C[C@@H]12 ZINC000248634355 1433812673 /nfs/dbraw/zinc/81/26/73/1433812673.db2.gz XIUCCFXQUGJIDR-FSPWUOQZSA-N 1 1 392.471 3.427 10 0 GGAEMO CCOC(=O)c1nn(C)cc1C[N@H+]1CCCCC[C@H]1C[C@@H](O)c1ccccc1 ZINC000248677645 1433814861 /nfs/dbraw/zinc/81/48/61/1433814861.db2.gz DLJNDWNQFSLOTM-VQTJNVASSA-N 1 1 385.508 3.465 10 0 GGAEMO c1ccc(CN2[C@@H]3CC[C@H]2C[C@H]([NH2+][C@H]2CCCN(c4ncccn4)C2)C3)cc1 ZINC000248826247 1433824266 /nfs/dbraw/zinc/82/42/66/1433824266.db2.gz GHXHKCMTTOAAMO-MYGLTJDJSA-N 1 1 377.536 3.231 10 0 GGAEMO c1ccc(CN2[C@@H]3CC[C@H]2C[C@@H]([NH2+][C@H]2CCCN(c4ncccn4)C2)C3)cc1 ZINC000248826241 1433824331 /nfs/dbraw/zinc/82/43/31/1433824331.db2.gz GHXHKCMTTOAAMO-KJJMTIBFSA-N 1 1 377.536 3.231 10 0 GGAEMO C[C@@H](C(=O)N(C)Cc1c(F)cccc1Cl)[N@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000249680412 1433848694 /nfs/dbraw/zinc/84/86/94/1433848694.db2.gz AMTVNJPQVZSRSP-UONOGXRCSA-N 1 1 378.879 3.429 10 0 GGAEMO CC(=O)NC[C@@H]1CCC[N@H+]([C@@H](C)C(=O)N[C@H](C)c2cccc3ccccc32)C1 ZINC000249810233 1433852537 /nfs/dbraw/zinc/85/25/37/1433852537.db2.gz HPIVIIBCNORQHC-AOIWGVFYSA-N 1 1 381.520 3.254 10 0 GGAEMO CCOc1cc(C[N@H+]2CC[C@@H](O)[C@@H](C)C2)ccc1OCC(=O)Nc1ccccc1 ZINC000249836989 1433853005 /nfs/dbraw/zinc/85/30/05/1433853005.db2.gz FOTVEOLOBUYTTH-FXAWDEMLSA-N 1 1 398.503 3.306 10 0 GGAEMO Cc1ccccc1OC[C@H](O)C[N@H+]1CCCC[C@H]1CNC(=O)OC(C)(C)C ZINC000251002552 1433857640 /nfs/dbraw/zinc/85/76/40/1433857640.db2.gz ZGXJKNAWUDUMCA-ZWKOTPCHSA-N 1 1 378.513 3.114 10 0 GGAEMO CCOc1ccc(-c2n[nH]cc2C[N@H+]2CCc3nc[nH]c(=O)c3CC2)cc1Cl ZINC000257174973 1433893255 /nfs/dbraw/zinc/89/32/55/1433893255.db2.gz MOOFYWNYIRARCP-UHFFFAOYSA-N 1 1 399.882 3.225 10 0 GGAEMO Cc1ccc(C[N@H+]2C[C@H](CNC(=O)N3CCCC3)C3(C2)CCOCC3)cc1C ZINC000257175269 1433893428 /nfs/dbraw/zinc/89/34/28/1433893428.db2.gz OJGFARGZEKWQCS-NRFANRHFSA-N 1 1 385.552 3.337 10 0 GGAEMO CCCn1c(C)c[nH+]c1C[C@@H]1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)C1 ZINC000257176481 1433893449 /nfs/dbraw/zinc/89/34/49/1433893449.db2.gz AKTJJRACOQMISW-KRWDZBQOSA-N 1 1 387.549 3.344 10 0 GGAEMO COc1ccc2[nH]c3c(c2c1)CC[N@H+](C)C31CCN(C(=O)c2ccoc2)CC1 ZINC000257176478 1433893462 /nfs/dbraw/zinc/89/34/62/1433893462.db2.gz AKSQFEJVFJVLME-UHFFFAOYSA-N 1 1 379.460 3.389 10 0 GGAEMO COc1ccc2[nH]c3c(c2c1)CC[N@@H+](C)C31CCN(C(=O)c2ccoc2)CC1 ZINC000257176478 1433893463 /nfs/dbraw/zinc/89/34/63/1433893463.db2.gz AKSQFEJVFJVLME-UHFFFAOYSA-N 1 1 379.460 3.389 10 0 GGAEMO CC(C)S(=O)(=O)N1CCC([N@H+]2C[C@@H](OCC3CC3)C23CCCCC3)CC1 ZINC000257175367 1433893466 /nfs/dbraw/zinc/89/34/66/1433893466.db2.gz AUKAXYQZQGECMU-LJQANCHMSA-N 1 1 384.586 3.003 10 0 GGAEMO Cc1ncsc1C[N@@H+]1CCC[C@@H](c2nc(C(C)C)no2)CCNC(=O)CC1 ZINC000257177841 1433893527 /nfs/dbraw/zinc/89/35/27/1433893527.db2.gz FKASUGGTZAGDND-OAHLLOKOSA-N 1 1 391.541 3.234 10 0 GGAEMO CN(CCc1ccccn1)C(=O)CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](C[N@H+]1C)[C@@H]23 ZINC000257177756 1433893628 /nfs/dbraw/zinc/89/36/28/1433893628.db2.gz BHRJNSOQDPQOFF-BQUSRXHISA-N 1 1 398.595 3.057 10 0 GGAEMO C[N@@H+](Cc1cccc(F)c1F)[C@H]1CCc2nnc(C3CCOCC3)n2CC1 ZINC000257177526 1433893671 /nfs/dbraw/zinc/89/36/71/1433893671.db2.gz WZEPDCOPDUMPEE-INIZCTEOSA-N 1 1 376.451 3.287 10 0 GGAEMO O=C(Cc1cccnc1)N1CCC([N@H+]2C[C@@H](OCC3CC3)C23CCCCC3)CC1 ZINC000257180270 1433893752 /nfs/dbraw/zinc/89/37/52/1433893752.db2.gz KLQNOBDROAQBHO-JOCHJYFZSA-N 1 1 397.563 3.429 10 0 GGAEMO O=C(NCc1ccccc1)[C@H]1CCC[N@@H+](Cc2ccccc2)CCC(=O)NCC1 ZINC000257183012 1433893910 /nfs/dbraw/zinc/89/39/10/1433893910.db2.gz QONCZOHQKGQJEC-QFIPXVFZSA-N 1 1 393.531 3.111 10 0 GGAEMO Cc1ccc(NC(=O)[C@H]2CCCCC[N@@H+](Cc3ccncc3)CCC(=O)N2)cc1 ZINC000257186664 1433894156 /nfs/dbraw/zinc/89/41/56/1433894156.db2.gz ZLMASYVZAAVROQ-OAQYLSRUSA-N 1 1 394.519 3.280 10 0 GGAEMO CN(Cc1ccncc1)C[C@H]1CCC2(CC[NH+](Cc3ccc(O)cc3)CC2)O1 ZINC000257192173 1433894527 /nfs/dbraw/zinc/89/45/27/1433894527.db2.gz STGKBXWLYPJFOO-JOCHJYFZSA-N 1 1 381.520 3.433 10 0 GGAEMO CC(C)[C@H](C)[N@H+]1Cc2cccc(NC(=O)C(=O)N(C)C[C@H]3CCCCO3)c2C1 ZINC000263942455 1434051455 /nfs/dbraw/zinc/05/14/55/1434051455.db2.gz DHFDFVQUJKFMIS-FUHWJXTLSA-N 1 1 387.524 3.013 10 0 GGAEMO Cc1c(-c2nc(-c3ccc(C[NH+]4CCOCC4)cc3)no2)sc2nccn12 ZINC000271027726 1434796843 /nfs/dbraw/zinc/79/68/43/1434796843.db2.gz NYMIDANKBDNSPU-UHFFFAOYSA-N 1 1 381.461 3.253 10 0 GGAEMO O=C1[C@H]([NH2+]C2CCN(CCc3ccccc3)CC2)CCN1Cc1ccccc1 ZINC000271433928 1434824589 /nfs/dbraw/zinc/82/45/89/1434824589.db2.gz FCWXEQYEZVYMBP-HSZRJFAPSA-N 1 1 377.532 3.084 10 0 GGAEMO O=C(CC[N@H+](CCO)C1CCOCC1)Nc1ccc(OCc2ccccc2)cc1 ZINC000275440448 1435139605 /nfs/dbraw/zinc/13/96/05/1435139605.db2.gz ABANSTZIFVGSHV-UHFFFAOYSA-N 1 1 398.503 3.068 10 0 GGAEMO Cc1[nH+]ccn1-c1ncccc1CN1C(=O)[C@@H]2CC[C@@H](c3ccccc3)N2C1=O ZINC000280312836 1435632823 /nfs/dbraw/zinc/63/28/23/1435632823.db2.gz CNFUNFOPOKXXIQ-OALUTQOASA-N 1 1 387.443 3.244 10 0 GGAEMO COc1ccccc1-n1nccc1C[N@@H+]1CCCN(Cc2cscn2)CC1 ZINC000280389840 1435651415 /nfs/dbraw/zinc/65/14/15/1435651415.db2.gz AMFAGAHUTBMIET-UHFFFAOYSA-N 1 1 383.521 3.045 10 0 GGAEMO COc1ccccc1-n1nccc1C[N@H+]1CCCN(Cc2cscn2)CC1 ZINC000280389840 1435651419 /nfs/dbraw/zinc/65/14/19/1435651419.db2.gz AMFAGAHUTBMIET-UHFFFAOYSA-N 1 1 383.521 3.045 10 0 GGAEMO COc1ccc(C[N@H+](Cc2nnc3n2CCOC3)C2CCCCC2)cc1OC ZINC000281236414 1435800237 /nfs/dbraw/zinc/80/02/37/1435800237.db2.gz IFLHDQXXJJHPMW-UHFFFAOYSA-N 1 1 386.496 3.160 10 0 GGAEMO COc1ccc(C[N@@H+](Cc2nnc3n2CCOC3)C2CCCCC2)cc1OC ZINC000281236414 1435800238 /nfs/dbraw/zinc/80/02/38/1435800238.db2.gz IFLHDQXXJJHPMW-UHFFFAOYSA-N 1 1 386.496 3.160 10 0 GGAEMO C[N@H+]1CCO[C@H]2CN(c3nc(-c4cccc(Cl)c4)nc4c3CCCC4)C[C@H]21 ZINC000301659897 719464197 /nfs/dbraw/zinc/46/41/97/719464197.db2.gz MGENGWOEIWVLDR-MOPGFXCFSA-N 1 1 384.911 3.195 10 0 GGAEMO C[N@H+]1CCO[C@@H]2CN(c3nc(-c4cccc(Cl)c4)nc4c3CCCC4)C[C@@H]21 ZINC000301659899 719464598 /nfs/dbraw/zinc/46/45/98/719464598.db2.gz MGENGWOEIWVLDR-RBUKOAKNSA-N 1 1 384.911 3.195 10 0 GGAEMO C[N@H+]1CCO[C@@H]2CN(c3nc(-c4cccc(Cl)c4)nc4c3CCCC4)C[C@H]21 ZINC000301659900 719464654 /nfs/dbraw/zinc/46/46/54/719464654.db2.gz MGENGWOEIWVLDR-RTBURBONSA-N 1 1 384.911 3.195 10 0 GGAEMO COc1ccc(OCc2nc(C[NH2+][C@H]3Cc4ccccc4[C@@H]3O)cs2)cc1 ZINC000172069046 1126076772 /nfs/dbraw/zinc/07/67/72/1126076772.db2.gz BXQYVFGYXPOOAE-FPOVZHCZSA-N 1 1 382.485 3.479 10 0 GGAEMO COc1ccccc1C[C@](C)(CO)[NH2+]Cc1nc2c3ccccc3oc2c(=O)[nH]1 ZINC001460698152 1126191868 /nfs/dbraw/zinc/19/18/68/1126191868.db2.gz PZRQIUOXEIVUBG-JOCHJYFZSA-N 1 1 393.443 3.174 10 0 GGAEMO O[C@H]([C@H](Cc1ccccc1)[NH2+]Cc1ccncc1Br)C(F)(F)F ZINC001560100052 1126207722 /nfs/dbraw/zinc/20/77/22/1126207722.db2.gz CWLAWDLZFANXCA-LSDHHAIUSA-N 1 1 389.215 3.468 10 0 GGAEMO C[C@](CO)(Cc1ccccc1F)[NH2+]Cc1nc(-c2cc(F)c(F)c(F)c2)no1 ZINC001654936547 1126254367 /nfs/dbraw/zinc/25/43/67/1126254367.db2.gz VZZDGMBQYRQBGT-LJQANCHMSA-N 1 1 395.356 3.376 10 0 GGAEMO Cc1cccc(N2CCN(C(=O)CCc3nnc(C4CCCCC4)o3)CC2)[nH+]1 ZINC000019145758 210229441 /nfs/dbraw/zinc/22/94/41/210229441.db2.gz PMKGOGCQLCYRKX-UHFFFAOYSA-N 1 1 383.496 3.102 10 0 GGAEMO Cc1cc(CNC(=O)C[N@H+](C)CCOc2ccc(Cl)cc2)cc(C)c1O ZINC000016695553 210194379 /nfs/dbraw/zinc/19/43/79/210194379.db2.gz FNZNQLQHVJGIMP-UHFFFAOYSA-N 1 1 376.884 3.289 10 0 GGAEMO Cc1cc(CNC(=O)C[N@@H+](C)CCOc2ccc(Cl)cc2)cc(C)c1O ZINC000016695553 210194382 /nfs/dbraw/zinc/19/43/82/210194382.db2.gz FNZNQLQHVJGIMP-UHFFFAOYSA-N 1 1 376.884 3.289 10 0 GGAEMO COC(=O)C1CCN(C(=O)C[N@H+](C)C(c2ccccc2)c2ccccc2)CC1 ZINC000016340809 210189060 /nfs/dbraw/zinc/18/90/60/210189060.db2.gz YQPCUJJEPALOFD-UHFFFAOYSA-N 1 1 380.488 3.119 10 0 GGAEMO COC(=O)C1CCN(C(=O)C[N@@H+](C)C(c2ccccc2)c2ccccc2)CC1 ZINC000016340809 210189064 /nfs/dbraw/zinc/18/90/64/210189064.db2.gz YQPCUJJEPALOFD-UHFFFAOYSA-N 1 1 380.488 3.119 10 0 GGAEMO Cc1nn(-c2ccccc2)nc1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000015988710 210181309 /nfs/dbraw/zinc/18/13/09/210181309.db2.gz SGLVHKAXSPLWRZ-SFHVURJKSA-N 1 1 379.464 3.126 10 0 GGAEMO CC[NH+]1CCN(C(=O)CSc2ncnc3c2sc2cccc(F)c23)CC1 ZINC000015863485 210176652 /nfs/dbraw/zinc/17/66/52/210176652.db2.gz VTBLCAKGOWGGKP-UHFFFAOYSA-N 1 1 390.509 3.240 10 0 GGAEMO CCn1nc(C(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)c2ccccc2c1=O ZINC000015787896 210171711 /nfs/dbraw/zinc/17/17/11/210171711.db2.gz ATZDEOGLXBTIEP-SFHVURJKSA-N 1 1 398.894 3.103 10 0 GGAEMO Cc1cc(-c2ccc(C)c(S(=O)(=O)NCCC[N@@H+]3CCC[C@H](C)C3)c2)on1 ZINC000015730271 210166218 /nfs/dbraw/zinc/16/62/18/210166218.db2.gz XJZIZHPJUDHUOX-HNNXBMFYSA-N 1 1 391.537 3.359 10 0 GGAEMO CC[NH+]1CCN(C(=O)c2c(C)nn(-c3ccc(C)cc3)c2-n2cccc2)CC1 ZINC000015681493 210164324 /nfs/dbraw/zinc/16/43/24/210164324.db2.gz VOCFBLGOWNQNDZ-UHFFFAOYSA-N 1 1 377.492 3.058 10 0 GGAEMO COCCc1ncc(CN2CC[C@]3(C2)CCC[N@@H+](Cc2ccccc2F)C3)cn1 ZINC000015069887 210148093 /nfs/dbraw/zinc/14/80/93/210148093.db2.gz ABZOKCJQCQKUQF-HSZRJFAPSA-N 1 1 398.526 3.293 10 0 GGAEMO COCCc1ncc(C[N@@H+]2CC[C@]3(C2)CCCN(Cc2ccccc2F)C3)cn1 ZINC000015069887 210148100 /nfs/dbraw/zinc/14/81/00/210148100.db2.gz ABZOKCJQCQKUQF-HSZRJFAPSA-N 1 1 398.526 3.293 10 0 GGAEMO COCCc1ncc(C[N@H+]2CC[C@]3(C2)CCCN(Cc2ccccc2F)C3)cn1 ZINC000015069887 210148104 /nfs/dbraw/zinc/14/81/04/210148104.db2.gz ABZOKCJQCQKUQF-HSZRJFAPSA-N 1 1 398.526 3.293 10 0 GGAEMO C[N@@H+](Cc1cn(-c2ccccc2)nc1-c1ccc2c(c1)OCO2)[C@H]1CCOC1 ZINC000015064346 210146196 /nfs/dbraw/zinc/14/61/96/210146196.db2.gz HYAAUHBIBMOMFE-IBGZPJMESA-N 1 1 377.444 3.489 10 0 GGAEMO C[C@H](C(=O)Nc1cccc(F)c1)[NH+]1CCC(C(=O)NCc2ccccc2)CC1 ZINC000015032135 210145236 /nfs/dbraw/zinc/14/52/36/210145236.db2.gz RDUXIMZPZBSDAU-MRXNPFEDSA-N 1 1 383.467 3.181 10 0 GGAEMO C[C@@H]1C[N@@H+](C2(C(=O)N3CCc4ccccc4C3)Cc3ccccc3C2)C[C@H](C)O1 ZINC000014977693 210138649 /nfs/dbraw/zinc/13/86/49/210138649.db2.gz YKQHFHHNPPCFIA-KDURUIRLSA-N 1 1 390.527 3.218 10 0 GGAEMO C[C@@H]1C[N@H+](C2(C(=O)N3CCc4ccccc4C3)Cc3ccccc3C2)C[C@H](C)O1 ZINC000014977693 210138645 /nfs/dbraw/zinc/13/86/45/210138645.db2.gz YKQHFHHNPPCFIA-KDURUIRLSA-N 1 1 390.527 3.218 10 0 GGAEMO CC(C)CN1C[C@@H](OCc2ccccn2)C[N@H+](CCc2ccccc2)CC1=O ZINC000014542277 210121760 /nfs/dbraw/zinc/12/17/60/210121760.db2.gz FDQUKRJDZVJOHK-QFIPXVFZSA-N 1 1 381.520 3.010 10 0 GGAEMO CC(C)CN1C[C@@H](OCc2ccccn2)C[N@@H+](CCc2ccccc2)CC1=O ZINC000014542277 210121762 /nfs/dbraw/zinc/12/17/62/210121762.db2.gz FDQUKRJDZVJOHK-QFIPXVFZSA-N 1 1 381.520 3.010 10 0 GGAEMO CC[NH+]1CCN(C(=O)c2nc(-c3ccccc3)n(-c3cccc(Cl)c3)n2)CC1 ZINC000014609454 210121528 /nfs/dbraw/zinc/12/15/28/210121528.db2.gz NBACPOJTFVUCPZ-UHFFFAOYSA-N 1 1 395.894 3.365 10 0 GGAEMO CCOC(=O)c1ccc(OC[C@H](O)C[N@H+]2CCC[C@@H]2c2ccc(OC)cc2)cc1 ZINC000014200933 210110420 /nfs/dbraw/zinc/11/04/20/210110420.db2.gz ZZRPTXNTVANOOK-DENIHFKCSA-N 1 1 399.487 3.449 10 0 GGAEMO CC(=O)N1CCc2cc(NC(=O)C[NH+]3CCC(c4ccc(O)cc4)CC3)ccc21 ZINC000012977035 210038675 /nfs/dbraw/zinc/03/86/75/210038675.db2.gz VJVWUHRBBNEGFG-UHFFFAOYSA-N 1 1 393.487 3.119 10 0 GGAEMO O=C(NCc1ccc(C[NH+]2CCOCC2)cc1)c1ccccc1C(F)(F)F ZINC000012980015 210037838 /nfs/dbraw/zinc/03/78/38/210037838.db2.gz JXYFPQWBTUMJQM-UHFFFAOYSA-N 1 1 378.394 3.468 10 0 GGAEMO CCOc1ccc(C[N@H+](C)CC(=O)N2c3ccccc3NC(=O)C[C@@H]2C)cc1 ZINC000012992200 210041904 /nfs/dbraw/zinc/04/19/04/210041904.db2.gz QPFZIRDJIUDYMP-INIZCTEOSA-N 1 1 381.476 3.281 10 0 GGAEMO CCOc1ccc(C[N@@H+](C)CC(=O)N2c3ccccc3NC(=O)C[C@@H]2C)cc1 ZINC000012992200 210041908 /nfs/dbraw/zinc/04/19/08/210041908.db2.gz QPFZIRDJIUDYMP-INIZCTEOSA-N 1 1 381.476 3.281 10 0 GGAEMO CCOc1ccc(NC(=O)C[NH+]2CCC(C(=O)N3CCCCCC3)CC2)cc1 ZINC000012940430 210034205 /nfs/dbraw/zinc/03/42/05/210034205.db2.gz PXULXCWZOFXQIA-UHFFFAOYSA-N 1 1 387.524 3.138 10 0 GGAEMO COc1ccc2nc(C(=O)N3CC[NH+](CCc4ccccc4)CC3)ccc2c1 ZINC000012946225 210033983 /nfs/dbraw/zinc/03/39/83/210033983.db2.gz VSEIXOJMLMXYDJ-UHFFFAOYSA-N 1 1 375.472 3.244 10 0 GGAEMO O=C(CSc1ncnc2sccc21)N[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000012881938 210022905 /nfs/dbraw/zinc/02/29/05/210022905.db2.gz PSXNVTCIBKFBJK-OAHLLOKOSA-N 1 1 384.530 3.174 10 0 GGAEMO COc1ccc([C@@H]2CCCCC[N@H+]2CC(=O)Nc2ccc(C(N)=O)cc2)cc1 ZINC000012879457 210022241 /nfs/dbraw/zinc/02/22/41/210022241.db2.gz RHYRMHDYLGNLKD-FQEVSTJZSA-N 1 1 381.476 3.350 10 0 GGAEMO Cc1ccc(C[N@H+](C)CC(=O)NCC(=O)Nc2c(C)cc(C)cc2C)c(C)c1 ZINC000012895700 210023722 /nfs/dbraw/zinc/02/37/22/210023722.db2.gz OORGYHAZIGATAM-UHFFFAOYSA-N 1 1 381.520 3.415 10 0 GGAEMO Cc1ccc(C[N@@H+](C)CC(=O)NCC(=O)Nc2c(C)cc(C)cc2C)c(C)c1 ZINC000012895700 210023727 /nfs/dbraw/zinc/02/37/27/210023727.db2.gz OORGYHAZIGATAM-UHFFFAOYSA-N 1 1 381.520 3.415 10 0 GGAEMO COc1cc(NC(=O)[C@@H](C)[N@H+](C)CCOc2ccccc2F)cc(OC)c1 ZINC000012857646 210018949 /nfs/dbraw/zinc/01/89/49/210018949.db2.gz RRQZBIVNMZUNII-CQSZACIVSA-N 1 1 376.428 3.181 10 0 GGAEMO COc1cc(NC(=O)[C@@H](C)[N@@H+](C)CCOc2ccccc2F)cc(OC)c1 ZINC000012857646 210018953 /nfs/dbraw/zinc/01/89/53/210018953.db2.gz RRQZBIVNMZUNII-CQSZACIVSA-N 1 1 376.428 3.181 10 0 GGAEMO Cc1cccc(NC(=O)[C@H](C)[NH+]2CCC(C(=O)NCc3ccccc3)CC2)c1 ZINC000012806854 210013693 /nfs/dbraw/zinc/01/36/93/210013693.db2.gz GZVBZEMURMJKRD-SFHVURJKSA-N 1 1 379.504 3.350 10 0 GGAEMO C[NH+](C)[C@@H](CNC(=O)Cc1ccc(N2CCCC2=O)cc1)c1ccccc1Cl ZINC000012764766 210005606 /nfs/dbraw/zinc/00/56/06/210005606.db2.gz OJCQQFWZGPBMKX-FQEVSTJZSA-N 1 1 399.922 3.428 10 0 GGAEMO NC(=O)c1ccsc1NC(=O)C[NH2+][C@@H](c1cccs1)c1ccc(F)cc1 ZINC000012690614 209991376 /nfs/dbraw/zinc/99/13/76/209991376.db2.gz OGINPMYDIKCHFF-MRXNPFEDSA-N 1 1 389.477 3.365 10 0 GGAEMO O=C(C[N@H+]1CC=C(c2ccccc2)CC1)N1CCN(c2ccc(F)cc2)CC1 ZINC000012542844 209971629 /nfs/dbraw/zinc/97/16/29/209971629.db2.gz IRYJSMXQCHPKSB-UHFFFAOYSA-N 1 1 379.479 3.264 10 0 GGAEMO O=C(C[N@@H+]1CC=C(c2ccccc2)CC1)N1CCN(c2ccc(F)cc2)CC1 ZINC000012542844 209971633 /nfs/dbraw/zinc/97/16/33/209971633.db2.gz IRYJSMXQCHPKSB-UHFFFAOYSA-N 1 1 379.479 3.264 10 0 GGAEMO Cc1ccc(Br)cc1NC(=O)CCNc1cc[nH+]c(N(C)C)n1 ZINC000525363157 532530883 /nfs/dbraw/zinc/53/08/83/532530883.db2.gz FTNJWVSQUCUPON-UHFFFAOYSA-N 1 1 378.274 3.054 10 0 GGAEMO COc1cc(C(C)=O)ccc1OC[C@H](O)C[N@H+]1CC=C(c2ccccc2)CC1 ZINC000002638549 209373763 /nfs/dbraw/zinc/37/37/63/209373763.db2.gz ALXYDOQAUOEARI-OAQYLSRUSA-N 1 1 381.472 3.427 10 0 GGAEMO COc1cc(C(C)=O)ccc1OC[C@H](O)C[N@@H+]1CC=C(c2ccccc2)CC1 ZINC000002638549 209373768 /nfs/dbraw/zinc/37/37/68/209373768.db2.gz ALXYDOQAUOEARI-OAQYLSRUSA-N 1 1 381.472 3.427 10 0 GGAEMO COc1cccc(C[N@@H+]2CCN(Cc3cc4ccccc4[nH]3)C[C@H]2CCO)c1 ZINC000036385638 209193640 /nfs/dbraw/zinc/19/36/40/209193640.db2.gz DNGUVEADOPDXFA-OAQYLSRUSA-N 1 1 379.504 3.245 10 0 GGAEMO COc1cccc(C[N@H+]2CCN(Cc3cc4ccccc4[nH]3)C[C@H]2CCO)c1 ZINC000036385638 209193646 /nfs/dbraw/zinc/19/36/46/209193646.db2.gz DNGUVEADOPDXFA-OAQYLSRUSA-N 1 1 379.504 3.245 10 0 GGAEMO CC(=O)c1ccc(OCC(=O)N[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C)cc1 ZINC000225326936 209187110 /nfs/dbraw/zinc/18/71/10/209187110.db2.gz KSKUFYIAYDLGLJ-HTAPYJJXSA-N 1 1 380.488 3.295 10 0 GGAEMO O=C1[C@@H]2CC=CC[C@H]2C(=O)N1C[N@@H+]1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000229503733 209186894 /nfs/dbraw/zinc/18/68/94/209186894.db2.gz XDWNBYLWWDCUEK-BZUAXINKSA-N 1 1 381.501 3.384 10 0 GGAEMO O=C1[C@@H]2CC=CC[C@H]2C(=O)N1C[N@H+]1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000229503733 209186898 /nfs/dbraw/zinc/18/68/98/209186898.db2.gz XDWNBYLWWDCUEK-BZUAXINKSA-N 1 1 381.501 3.384 10 0 GGAEMO CCn1ccnc1[C@H]1OCCC[C@@H]1NC1CC[NH+](CCc2ccccc2)CC1 ZINC000190433580 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CCC[NH+]1CCC(NCc2nc(-c3ccc(Br)cc3)n[nH]2)CC1 ZINC000121089607 564352402 /nfs/dbraw/zinc/35/24/02/564352402.db2.gz PRMYUZROYLQUIJ-UHFFFAOYSA-N 1 1 378.318 3.198 10 0 GGAEMO CCC[NH+]1CCC(NCc2n[nH]c(-c3ccc(Br)cc3)n2)CC1 ZINC000121089607 564352404 /nfs/dbraw/zinc/35/24/04/564352404.db2.gz PRMYUZROYLQUIJ-UHFFFAOYSA-N 1 1 378.318 3.198 10 0 GGAEMO COC(=O)[C@H](c1cccc(Br)c1)N1CCC[C@@H]1Cn1cc[nH+]c1C ZINC000121146080 564355794 /nfs/dbraw/zinc/35/57/94/564355794.db2.gz PVMKPFDPVWQOBG-SJORKVTESA-N 1 1 392.297 3.333 10 0 GGAEMO Cc1ccc(C(=O)N(C)[C@H]2CC[N@H+](C)C[C@@H]2C)cc1I ZINC000121162382 564357329 /nfs/dbraw/zinc/35/73/29/564357329.db2.gz AGZGVCLLXXIYQC-WFASDCNBSA-N 1 1 386.277 3.012 10 0 GGAEMO CSc1ncc(Cl)c(C(=O)N2CCC[N@H+](Cc3cccs3)CC2)n1 ZINC000028036741 564358803 /nfs/dbraw/zinc/35/88/03/564358803.db2.gz XKVDVTNVLROBDM-UHFFFAOYSA-N 1 1 382.942 3.262 10 0 GGAEMO CSc1ncc(Cl)c(C(=O)N2CCC[N@@H+](Cc3cccs3)CC2)n1 ZINC000028036741 564358804 /nfs/dbraw/zinc/35/88/04/564358804.db2.gz 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564503672 /nfs/dbraw/zinc/50/36/72/564503672.db2.gz KOUPLZXGPTXOEP-FZMZJTMJSA-N 1 1 395.301 3.381 10 0 GGAEMO CC(C)[C@H](CNC(=O)NCc1ccc(Cl)cc1Cl)N1CC[NH+](C)CC1 ZINC000125325590 564511207 /nfs/dbraw/zinc/51/12/07/564511207.db2.gz UYWHHZRTHLEQLD-KRWDZBQOSA-N 1 1 387.355 3.065 10 0 GGAEMO C[C@@H](CNC(=O)N1CCC[C@@H](C(F)(F)F)C1)[N@@H+]1CCc2sccc2C1 ZINC000047010855 564511947 /nfs/dbraw/zinc/51/19/47/564511947.db2.gz MEBFQNLXNWAIBR-GXTWGEPZSA-N 1 1 375.460 3.479 10 0 GGAEMO C[C@@H](CNC(=O)N1CCC[C@@H](C(F)(F)F)C1)[N@H+]1CCc2sccc2C1 ZINC000047010855 564511952 /nfs/dbraw/zinc/51/19/52/564511952.db2.gz MEBFQNLXNWAIBR-GXTWGEPZSA-N 1 1 375.460 3.479 10 0 GGAEMO O[C@H](COC[C@@H]1CCCO1)C[N@@H+](Cc1csc(Br)c1)C1CC1 ZINC000125344408 564512259 /nfs/dbraw/zinc/51/22/59/564512259.db2.gz OMUZSKNMLCCJLF-GJZGRUSLSA-N 1 1 390.343 3.032 10 0 GGAEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc(-n2cc(Br)cn2)cc1 ZINC000047143862 564513417 /nfs/dbraw/zinc/51/34/17/564513417.db2.gz YVCYTOCUMOPOHK-AWEZNQCLSA-N 1 1 391.313 3.239 10 0 GGAEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1ccc(F)cc1I ZINC000047144274 564514278 /nfs/dbraw/zinc/51/42/78/564514278.db2.gz NAGBBBLCFIJMGS-NSHDSACASA-N 1 1 390.240 3.035 10 0 GGAEMO COc1cccc([C@@H](CNc2ncncc2Br)[NH+]2CCCC2)c1 ZINC000481711065 564520338 /nfs/dbraw/zinc/52/03/38/564520338.db2.gz KCOVBAJNIPXOJE-MRXNPFEDSA-N 1 1 377.286 3.497 10 0 GGAEMO C[C@@H](c1ccc(S(N)(=O)=O)cc1)[N@H+](C)Cc1csc(Br)c1 ZINC000047717132 564525773 /nfs/dbraw/zinc/52/57/73/564525773.db2.gz RYTVVKROOTXODJ-JTQLQIEISA-N 1 1 389.340 3.351 10 0 GGAEMO C[C@@H](c1ccc(S(N)(=O)=O)cc1)[N@@H+](C)Cc1csc(Br)c1 ZINC000047717132 564525776 /nfs/dbraw/zinc/52/57/76/564525776.db2.gz RYTVVKROOTXODJ-JTQLQIEISA-N 1 1 389.340 3.351 10 0 GGAEMO C[N@@H+](Cc1ccc2c(c1)OCCO2)[C@@H](CO)c1cccc(Br)c1 ZINC000125758123 564526054 /nfs/dbraw/zinc/52/60/54/564526054.db2.gz MXXNZVFDYCGVRN-INIZCTEOSA-N 1 1 378.266 3.386 10 0 GGAEMO CC[N@H+]1CC[C@@H](CNC(=O)Nc2nnc(-c3c(F)cccc3Cl)s2)C1 ZINC000481917394 564528273 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GGAEMO C[N@H+]1CCC[C@H](NC(=O)Nc2cc(Br)ccc2Br)C1 ZINC000048770456 564545917 /nfs/dbraw/zinc/54/59/17/564545917.db2.gz XYJBJYOQWRHKPM-JTQLQIEISA-N 1 1 391.107 3.427 10 0 GGAEMO CCc1[nH+]ccn1[C@@H]1CCCN(C(=O)Nc2cncc(Br)c2)C1 ZINC000126487783 564550248 /nfs/dbraw/zinc/55/02/48/564550248.db2.gz UPPZYJWCIDXOAP-CQSZACIVSA-N 1 1 378.274 3.472 10 0 GGAEMO Cc1nn(-c2ccc(Br)cc2)cc1C[N@@H+]1[C@@H]2CC[C@H]1CC(O)C2 ZINC000126553460 564553574 /nfs/dbraw/zinc/55/35/74/564553574.db2.gz BXFWIKUUMRPXPU-JWTNVVGKSA-N 1 1 376.298 3.431 10 0 GGAEMO C[N@@H+](CCOc1ccccc1Br)[C@H]1CCCN(c2cccnn2)C1 ZINC000126619906 564555629 /nfs/dbraw/zinc/55/56/29/564555629.db2.gz FJAAVILJEFLUFV-HNNXBMFYSA-N 1 1 391.313 3.219 10 0 GGAEMO C[C@@H]([NH2+][C@@H]1CCCNC1=O)c1ccc(Br)cc1Br ZINC000050395109 564557814 /nfs/dbraw/zinc/55/78/14/564557814.db2.gz BDSFKFHSJMNOIU-PRHODGIISA-N 1 1 376.092 3.141 10 0 GGAEMO C[C@H]([NH2+][C@@H]1CCCNC1=O)c1ccc(Br)cc1Br ZINC000050395108 564558360 /nfs/dbraw/zinc/55/83/60/564558360.db2.gz 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Cc1c(I)cccc1C(=O)N[C@H]1C[N@@H+](C(C)C)C[C@@H]1C ZINC000127359927 564582085 /nfs/dbraw/zinc/58/20/85/564582085.db2.gz HLXIUKPSFSSZJH-NHYWBVRUSA-N 1 1 386.277 3.058 10 0 GGAEMO O[C@H](COC1CCOCC1)C[N@H+]1CCC[C@H]1Cc1ccc(Br)cc1 ZINC000127440014 564584589 /nfs/dbraw/zinc/58/45/89/564584589.db2.gz AJGXXLIORNZOEB-ROUUACIJSA-N 1 1 398.341 3.013 10 0 GGAEMO C[C@H](NC(=O)NCCC[NH+]1CCOCC1)c1c(Cl)ccc(F)c1Cl ZINC000127527199 564587038 /nfs/dbraw/zinc/58/70/38/564587038.db2.gz USIXYJSLRRGBNW-NSHDSACASA-N 1 1 378.275 3.215 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CNC(=S)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000053537734 564590464 /nfs/dbraw/zinc/59/04/64/564590464.db2.gz YAULMRJFSSUCQG-UKRRQHHQSA-N 1 1 398.370 3.221 10 0 GGAEMO CC[C@@H]1CN(C(=O)c2cc(Cl)cc(C(F)(F)F)c2)CC[N@H+]1C[C@@H](C)O ZINC000127810664 564596928 /nfs/dbraw/zinc/59/69/28/564596928.db2.gz CBURVFWDBTXUMF-IAQYHMDHSA-N 1 1 378.822 3.276 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2cc(C)ccc2Br)[C@H](C)C1 ZINC000127812681 564596946 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CN(C)c1nc(NC[C@H]2CCN(c3cccc(Br)c3)C2)cc[nH+]1 ZINC000525362824 564699002 /nfs/dbraw/zinc/69/90/02/564699002.db2.gz CTBAGTWQDUCDHQ-CYBMUJFWSA-N 1 1 376.302 3.244 10 0 GGAEMO Cc1ccc(C[N@H+](Cc2ccco2)C[C@@H]2CCCN(S(C)(=O)=O)C2)s1 ZINC000131191531 564704416 /nfs/dbraw/zinc/70/44/16/564704416.db2.gz PSRCHIWBRYQAFM-INIZCTEOSA-N 1 1 382.551 3.323 10 0 GGAEMO Cc1sc2ncnc(SCC(=O)N3CCC[N@H+](C4CC4)CC3)c2c1C ZINC000061605727 564706856 /nfs/dbraw/zinc/70/68/56/564706856.db2.gz OZZZCZVVOHTLFA-UHFFFAOYSA-N 1 1 376.551 3.097 10 0 GGAEMO CSc1cc(C(=O)N2CC[N@H+](C[C@@H](C)O)[C@@H](C)C2)c(Cl)cc1Cl ZINC000131296693 564707461 /nfs/dbraw/zinc/70/74/61/564707461.db2.gz ZOYQTTVSUZKQOC-WDEREUQCSA-N 1 1 377.337 3.242 10 0 GGAEMO CSc1cc(C(=O)N2CC[N@@H+](C[C@@H](C)O)[C@@H](C)C2)c(Cl)cc1Cl ZINC000131296693 564707464 /nfs/dbraw/zinc/70/74/64/564707464.db2.gz ZOYQTTVSUZKQOC-WDEREUQCSA-N 1 1 377.337 3.242 10 0 GGAEMO CCc1ccc(S(=O)(=O)NCc2ccc(-n3cc[nH+]c3C)c(F)c2)s1 ZINC000063197780 564715263 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CCc1nc(C[NH+]2CCC(CNC(=O)NCCCCSC)CC2)cs1 ZINC000132315684 564739837 /nfs/dbraw/zinc/73/98/37/564739837.db2.gz NXVDFJGVGYSFBU-UHFFFAOYSA-N 1 1 384.615 3.360 10 0 GGAEMO CCN(CC)C(=O)[C@H]1CCC[N@H+]1C[C@H](O)COc1c(Cl)cccc1Cl ZINC000065297657 564741980 /nfs/dbraw/zinc/74/19/80/564741980.db2.gz NEJVIMIBPZLYAU-XJKSGUPXSA-N 1 1 389.323 3.066 10 0 GGAEMO CCC[NH+]1CCN(C(=O)CSCc2ccc(Br)cc2F)CC1 ZINC000065323183 564742455 /nfs/dbraw/zinc/74/24/55/564742455.db2.gz PTJPIPHVXURYHD-UHFFFAOYSA-N 1 1 389.334 3.376 10 0 GGAEMO O=C(CCC(=O)N1CCC[N@H+]2CCC[C@@H]2C1)c1ccc(Br)cc1 ZINC000065578398 564744861 /nfs/dbraw/zinc/74/48/61/564744861.db2.gz SWELHWSCNVFVCT-MRXNPFEDSA-N 1 1 379.298 3.109 10 0 GGAEMO C[C@@H]1C[N@H+](C2CCN(CC(=O)Nc3c(Cl)cccc3Cl)CC2)CCO1 ZINC000066561752 564769173 /nfs/dbraw/zinc/76/91/73/564769173.db2.gz PTLFUSZKFNMPQQ-CYBMUJFWSA-N 1 1 386.323 3.117 10 0 GGAEMO CN(CCc1nccs1)C(=O)NC[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000133303067 564769292 /nfs/dbraw/zinc/76/92/92/564769292.db2.gz 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397.292 3.102 10 0 GGAEMO Cc1nc([C@@H]2CCC[N@H+](C[C@](C)(O)c3ccc(Br)cc3F)C2)n[nH]1 ZINC000292774489 565133485 /nfs/dbraw/zinc/13/34/85/565133485.db2.gz KALLMIRCRCHBNX-PXAZEXFGSA-N 1 1 397.292 3.102 10 0 GGAEMO Cc1nc([C@@H]2CCC[N@@H+](C[C@](C)(O)c3ccc(Br)cc3F)C2)n[nH]1 ZINC000292774489 565133490 /nfs/dbraw/zinc/13/34/90/565133490.db2.gz KALLMIRCRCHBNX-PXAZEXFGSA-N 1 1 397.292 3.102 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)Nc1ccc(Cl)cc1OC(F)F ZINC000184397101 565133611 /nfs/dbraw/zinc/13/36/11/565133611.db2.gz SABKCJCHAUPVPQ-GFCCVEGCSA-N 1 1 377.819 3.174 10 0 GGAEMO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]CC(=O)Nc1ccc(Br)cn1 ZINC000157555291 565136458 /nfs/dbraw/zinc/13/64/58/565136458.db2.gz RTIDNMKWCLLSCS-NSHDSACASA-N 1 1 394.317 3.393 10 0 GGAEMO C[C@@H]1C[N@H+](CCCCNC(=O)Cc2ccc(Br)s2)C[C@H](C)O1 ZINC000268025960 565138498 /nfs/dbraw/zinc/13/84/98/565138498.db2.gz SVSHTXKWEFYKFO-BETUJISGSA-N 1 1 389.359 3.059 10 0 GGAEMO Cc1cnc(CC[N@@H+](C)CC(=O)N(C)CCOc2ccc(Cl)cc2)s1 ZINC000157667614 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Cc1cnc(CC[N@H+](C)C[C@H](O)COc2ccc(Br)cc2)s1 ZINC000157838982 565144699 /nfs/dbraw/zinc/14/46/99/565144699.db2.gz PHKYFPSKQHGSBA-AWEZNQCLSA-N 1 1 385.327 3.128 10 0 GGAEMO CCOCCO[C@H]1CC[N@H+](Cc2nnc(-c3ccccc3Br)o2)C1 ZINC000157831358 565144924 /nfs/dbraw/zinc/14/49/24/565144924.db2.gz FAJTXQZWSNMQGY-ZDUSSCGKSA-N 1 1 396.285 3.127 10 0 GGAEMO CCOCCO[C@H]1CC[N@@H+](Cc2nnc(-c3ccccc3Br)o2)C1 ZINC000157831358 565144932 /nfs/dbraw/zinc/14/49/32/565144932.db2.gz FAJTXQZWSNMQGY-ZDUSSCGKSA-N 1 1 396.285 3.127 10 0 GGAEMO C[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1cccnc1Br ZINC000268255984 565145707 /nfs/dbraw/zinc/14/57/07/565145707.db2.gz XYLFRYVCZIPIHA-RHSMWYFYSA-N 1 1 388.309 3.485 10 0 GGAEMO C[C@@H]1C[C@H](N(C)C(=O)c2ccn(-c3ccc(Br)cc3)n2)CC[N@H+]1C ZINC000293050019 565148571 /nfs/dbraw/zinc/14/85/71/565148571.db2.gz AFYLBFOJJPGLJB-CZUORRHYSA-N 1 1 391.313 3.190 10 0 GGAEMO Cc1ccc(N2CCC(NC(=O)Cc3cccc(Br)c3)CC2)[nH+]c1 ZINC000157928805 565148941 /nfs/dbraw/zinc/14/89/41/565148941.db2.gz HDSFMNYBZNITRM-UHFFFAOYSA-N 1 1 388.309 3.480 10 0 GGAEMO CN(C(=O)c1cc(Cl)sc1Cl)[C@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000370831397 565163558 /nfs/dbraw/zinc/16/35/58/565163558.db2.gz USHPUTYQBIWURG-LBPRGKRZSA-N 1 1 376.353 3.295 10 0 GGAEMO CN(C(=O)c1cc(Cl)sc1Cl)[C@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000370831397 565163563 /nfs/dbraw/zinc/16/35/63/565163563.db2.gz USHPUTYQBIWURG-LBPRGKRZSA-N 1 1 376.353 3.295 10 0 GGAEMO CC[C@@H](O)C[NH+]1CCN(C(=O)N[C@H](C)c2c(Cl)ccc(F)c2Cl)CC1 ZINC000184922046 565166608 /nfs/dbraw/zinc/16/66/08/565166608.db2.gz HHIJICRLZLODEO-VXGBXAGGSA-N 1 1 392.302 3.292 10 0 GGAEMO C[C@@H]1C[N@H+](C2CCN(Cc3nc4cc(Br)ccc4[nH]3)CC2)CCO1 ZINC000184953032 565167879 /nfs/dbraw/zinc/16/78/79/565167879.db2.gz PCBSIRQJWSFVSS-CYBMUJFWSA-N 1 1 393.329 3.011 10 0 GGAEMO C[C@@H]1C[N@@H+](C2CCN(Cc3nc4ccc(Br)cc4[nH]3)CC2)CCO1 ZINC000184953032 565167887 /nfs/dbraw/zinc/16/78/87/565167887.db2.gz PCBSIRQJWSFVSS-CYBMUJFWSA-N 1 1 393.329 3.011 10 0 GGAEMO C[C@@H]1C[N@H+](C2CCN(Cc3nc4ccc(Br)cc4[nH]3)CC2)CCO1 ZINC000184953032 565167891 /nfs/dbraw/zinc/16/78/91/565167891.db2.gz PCBSIRQJWSFVSS-CYBMUJFWSA-N 1 1 393.329 3.011 10 0 GGAEMO Brc1ccc2[nH]c(C[NH+]3CCC(OC[C@H]4CCCO4)CC3)nc2c1 ZINC000184980077 565168940 /nfs/dbraw/zinc/16/89/40/565168940.db2.gz CMKDKNHUQQPCIF-OAHLLOKOSA-N 1 1 394.313 3.485 10 0 GGAEMO CCCNC(=O)C1CC[NH+](Cc2nc3cc(Br)ccc3[nH]2)CC1 ZINC000184969641 565169279 /nfs/dbraw/zinc/16/92/79/565169279.db2.gz XODYDPORARTXGX-UHFFFAOYSA-N 1 1 379.302 3.064 10 0 GGAEMO Cc1nc(C[C@@H]2CCC[N@H+](C[C@H](O)c3ccc(F)c(Br)c3)C2)no1 ZINC000184992979 565170760 /nfs/dbraw/zinc/17/07/60/565170760.db2.gz VVSLGTOQSVRHPP-LRDDRELGSA-N 1 1 398.276 3.268 10 0 GGAEMO Cc1nc(C[C@@H]2CCC[N@@H+](C[C@H](O)c3ccc(F)c(Br)c3)C2)no1 ZINC000184992979 565170765 /nfs/dbraw/zinc/17/07/65/565170765.db2.gz VVSLGTOQSVRHPP-LRDDRELGSA-N 1 1 398.276 3.268 10 0 GGAEMO CCSCC[NH+]1CCN(CC(=O)Nc2ccccc2C(F)(F)F)CC1 ZINC000158485943 565171234 /nfs/dbraw/zinc/17/12/34/565171234.db2.gz WCQXOQMOFSVRNA-UHFFFAOYSA-N 1 1 375.460 3.015 10 0 GGAEMO Cc1cc2cc(S(=O)(=O)N(C)[C@@H]3CC[N@@H+](C)[C@H](C)C3)ccc2nc1Cl ZINC000293527418 565173552 /nfs/dbraw/zinc/17/35/52/565173552.db2.gz PCVRPMCWWGGCGS-UKRRQHHQSA-N 1 1 381.929 3.300 10 0 GGAEMO Cc1c(Br)scc1C(=O)N1CCC([N@@H+]2CCO[C@H](C)C2)CC1 ZINC000185093983 565177325 /nfs/dbraw/zinc/17/73/25/565177325.db2.gz NUSZYBLMRYFBLL-LLVKDONJSA-N 1 1 387.343 3.144 10 0 GGAEMO COCC[N@@H+](C)CCNC(=O)[C@H]1CCCO[C@@H]1c1ccc(Cl)cc1Cl ZINC000185169643 565183041 /nfs/dbraw/zinc/18/30/41/565183041.db2.gz YCHNSJLWRADJRE-DOTOQJQBSA-N 1 1 389.323 3.156 10 0 GGAEMO COCC[N@@H+](C)CCNC(=O)[C@@H]1CCCO[C@@H]1c1ccc(Cl)cc1Cl ZINC000185169623 565183197 /nfs/dbraw/zinc/18/31/97/565183197.db2.gz YCHNSJLWRADJRE-NVXWUHKLSA-N 1 1 389.323 3.156 10 0 GGAEMO C[C@](O)(C[N@H+]1CCCN(CC(F)F)CC1)c1ccc(Br)cc1F ZINC000293778023 565183795 /nfs/dbraw/zinc/18/37/95/565183795.db2.gz LNNIIAVLXQYZLS-INIZCTEOSA-N 1 1 395.263 3.069 10 0 GGAEMO C[C@H](CC(=O)c1cccc(Br)c1)C(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000371301336 565186539 /nfs/dbraw/zinc/18/65/39/565186539.db2.gz FDQXBWOMLKWPRC-BXUZGUMPSA-N 1 1 390.281 3.055 10 0 GGAEMO C[C@](O)(C[N@H+]1CCC[C@H](c2ncc[nH]2)C1)c1ccc(Br)cc1F ZINC000293836406 565186945 /nfs/dbraw/zinc/18/69/45/565186945.db2.gz QECSLLIXUWWOFC-SJCJKPOMSA-N 1 1 382.277 3.398 10 0 GGAEMO CCc1[nH+]ccn1[C@H]1CCCN(S(=O)(=O)c2cnc(Cl)c(Cl)c2)C1 ZINC000158932688 565187120 /nfs/dbraw/zinc/18/71/20/565187120.db2.gz SHYGSWGYLYCCDS-NSHDSACASA-N 1 1 389.308 3.173 10 0 GGAEMO CN1C[C@H]([NH2+][C@@H](c2ccc(Br)o2)c2ccc(F)cc2)CCC1=O ZINC000293855070 565187136 /nfs/dbraw/zinc/18/71/36/565187136.db2.gz UIHYZMVNARZNBW-CXAGYDPISA-N 1 1 381.245 3.481 10 0 GGAEMO C[C@@](O)(C[N@H+]1CCC[C@@H](c2ncc[nH]2)C1)c1ccc(Br)cc1F ZINC000293836410 565187467 /nfs/dbraw/zinc/18/74/67/565187467.db2.gz QECSLLIXUWWOFC-SJKOYZFVSA-N 1 1 382.277 3.398 10 0 GGAEMO CC(C)C[C@H](CO)[N@@H+](C)CC(=O)Nc1ccc(Br)cc1Cl ZINC000185335207 565196016 /nfs/dbraw/zinc/19/60/16/565196016.db2.gz QDDHYBDRRIWQNA-GFCCVEGCSA-N 1 1 377.710 3.380 10 0 GGAEMO COC(=O)c1cc(Cl)cc(Cl)c1NC(=O)C[N@H+](C)[C@@H](CO)CC(C)C ZINC000185335437 565196136 /nfs/dbraw/zinc/19/61/36/565196136.db2.gz AXQLJIUAZPHBBG-GFCCVEGCSA-N 1 1 391.295 3.057 10 0 GGAEMO COC(=O)c1cc(Cl)cc(Cl)c1NC(=O)C[N@@H+](C)[C@@H](CO)CC(C)C ZINC000185335437 565196143 /nfs/dbraw/zinc/19/61/43/565196143.db2.gz AXQLJIUAZPHBBG-GFCCVEGCSA-N 1 1 391.295 3.057 10 0 GGAEMO CC[C@H]1CN(C(=O)c2csc(Br)c2C)CC[N@@H+]1CCOC ZINC000185450935 565202644 /nfs/dbraw/zinc/20/26/44/565202644.db2.gz KPVMEKAHGHWAEE-LBPRGKRZSA-N 1 1 375.332 3.002 10 0 GGAEMO CC[C@H]1CN(C(=O)c2csc(Br)c2C)CC[N@H+]1CCOC ZINC000185450935 565202646 /nfs/dbraw/zinc/20/26/46/565202646.db2.gz KPVMEKAHGHWAEE-LBPRGKRZSA-N 1 1 375.332 3.002 10 0 GGAEMO CC[N@@H+](CC(=O)Nc1c(Cl)cccc1Cl)C[C@@H](O)COC(C)(C)C ZINC000185490878 565204350 /nfs/dbraw/zinc/20/43/50/565204350.db2.gz MQBOHGONUDWKQH-GFCCVEGCSA-N 1 1 377.312 3.430 10 0 GGAEMO CC[N@H+](CC(=O)Nc1c(Cl)cccc1Cl)C[C@@H](O)COC(C)(C)C ZINC000185490878 565204354 /nfs/dbraw/zinc/20/43/54/565204354.db2.gz MQBOHGONUDWKQH-GFCCVEGCSA-N 1 1 377.312 3.430 10 0 GGAEMO O[C@@H](COC1CCOCC1)C[N@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000371715969 565207222 /nfs/dbraw/zinc/20/72/22/565207222.db2.gz MFJZYUHRZNVZDZ-OCCSQVGLSA-N 1 1 390.343 3.204 10 0 GGAEMO O=C(NCCc1cc(Br)ccc1F)N1CCC(c2cnc[nH]2)CC1 ZINC000371901753 565214211 /nfs/dbraw/zinc/21/42/11/565214211.db2.gz CXSAJBBOMIOWRZ-UHFFFAOYSA-N 1 1 395.276 3.443 10 0 GGAEMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000371911879 565215819 /nfs/dbraw/zinc/21/58/19/565215819.db2.gz PXMIXERIZBDMGU-KCXAZCMYSA-N 1 1 396.329 3.254 10 0 GGAEMO C[C@@H](CC(=O)N1CCC([N@@H+](C)CCCO)CC1)c1ccc(Br)cc1 ZINC000270391022 565217260 /nfs/dbraw/zinc/21/72/60/565217260.db2.gz SEJJYRCVXXCBLI-HNNXBMFYSA-N 1 1 397.357 3.248 10 0 GGAEMO COc1cc(Br)c(C(=O)NCC[N@H+]2CCCC[C@@H]2C)cc1OC ZINC000294548146 565218086 /nfs/dbraw/zinc/21/80/86/565218086.db2.gz QTDIMWFTBVTSMC-LBPRGKRZSA-N 1 1 385.302 3.071 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2ccc(SC)c(Cl)c2)[C@H](C)C1 ZINC000185755883 565219978 /nfs/dbraw/zinc/21/99/78/565219978.db2.gz RZSOVZGRCZDKSG-IUODEOHRSA-N 1 1 376.975 3.413 10 0 GGAEMO CSc1ccc(S(=O)(=O)N2CCC[C@H]2Cn2cc[nH+]c2C)cc1Cl ZINC000185796098 565221593 /nfs/dbraw/zinc/22/15/93/565221593.db2.gz LOBIDJKDFRGARF-ZDUSSCGKSA-N 1 1 385.942 3.420 10 0 GGAEMO C[N@H+]1CC[C@H](NC(=O)c2[nH]nc(C3CC3)c2Br)[C@@H]1c1ccccc1 ZINC000270638792 565224861 /nfs/dbraw/zinc/22/48/61/565224861.db2.gz KLUBREIDXBBACM-GUYCJALGSA-N 1 1 389.297 3.225 10 0 GGAEMO C[N@H+]1CC[C@@H](NC(=O)c2[nH]nc(C3CC3)c2Br)[C@@H]1c1ccccc1 ZINC000270638789 565225257 /nfs/dbraw/zinc/22/52/57/565225257.db2.gz KLUBREIDXBBACM-DYVFJYSZSA-N 1 1 389.297 3.225 10 0 GGAEMO C[C@@]1(C(N)=O)CCCC[N@@H+]1Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000185905337 565227485 /nfs/dbraw/zinc/22/74/85/565227485.db2.gz JUUCXEKJIABOTK-SFHVURJKSA-N 1 1 389.297 3.136 10 0 GGAEMO C[C@@]1(C(N)=O)CCCC[N@H+]1Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000185905337 565227488 /nfs/dbraw/zinc/22/74/88/565227488.db2.gz JUUCXEKJIABOTK-SFHVURJKSA-N 1 1 389.297 3.136 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(C(=O)COc2cccc(Br)c2)CC1 ZINC000372306750 565231519 /nfs/dbraw/zinc/23/15/19/565231519.db2.gz AKWVLROAAGJFFH-UHFFFAOYSA-N 1 1 378.270 3.197 10 0 GGAEMO COc1cc(Br)c(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1OC ZINC000294915688 565235631 /nfs/dbraw/zinc/23/56/31/565235631.db2.gz KEHQJXMHXPLPMO-YHWZYXNKSA-N 1 1 397.313 3.211 10 0 GGAEMO C[C@@H]1CN(Cc2nnc(-c3ccccc3Br)o2)CC[N@H+](C2CC2)C1 ZINC000294952324 565237095 /nfs/dbraw/zinc/23/70/95/565237095.db2.gz AWKAOUGREHFUAN-CYBMUJFWSA-N 1 1 391.313 3.415 10 0 GGAEMO NC(=O)c1ccc(C[NH2+][C@@H](c2ccc(Br)cc2)c2cncnc2)cc1 ZINC000186077263 565238349 /nfs/dbraw/zinc/23/83/49/565238349.db2.gz GJEFARMBIGKKFQ-SFHVURJKSA-N 1 1 397.276 3.217 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CN[C@@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186083165 565238377 /nfs/dbraw/zinc/23/83/77/565238377.db2.gz ZAZNCEYABBINNF-MSOLQXFVSA-N 1 1 375.314 3.402 10 0 GGAEMO CCN1CCC[C@@H]1C[NH2+][C@@H](c1ccc(Br)cc1)c1cncnc1 ZINC000186083165 565238380 /nfs/dbraw/zinc/23/83/80/565238380.db2.gz ZAZNCEYABBINNF-MSOLQXFVSA-N 1 1 375.314 3.402 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(OC)c(OC)cc2Br)[C@@H](C)C1 ZINC000295004000 565239005 /nfs/dbraw/zinc/23/90/05/565239005.db2.gz PLGHGIOMFAEHFK-SWLSCSKDSA-N 1 1 399.329 3.269 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(OC)c(OC)cc2Br)[C@H](C)C1 ZINC000295003997 565239600 /nfs/dbraw/zinc/23/96/00/565239600.db2.gz PLGHGIOMFAEHFK-IUODEOHRSA-N 1 1 399.329 3.269 10 0 GGAEMO CC[N@H+]1CC[C@H](CN[C@@H](c2ccc(Br)cc2)c2cncnc2)C1 ZINC000186116789 565241044 /nfs/dbraw/zinc/24/10/44/565241044.db2.gz RAEVKBDXWMMJKN-KDOFPFPSSA-N 1 1 375.314 3.260 10 0 GGAEMO Brc1ccc([C@@H](NC[C@H]2CC[N@H+](C3CC3)C2)c2cncnc2)cc1 ZINC000186105167 565241409 /nfs/dbraw/zinc/24/14/09/565241409.db2.gz MFSGABCZFXSWNE-AUUYWEPGSA-N 1 1 387.325 3.402 10 0 GGAEMO C[N@@H+]1CC[C@H](NC(=O)N2CCc3ncsc3C2)[C@@H]1c1ccc(Cl)cc1 ZINC000372574441 565245409 /nfs/dbraw/zinc/24/54/09/565245409.db2.gz VNGVTCZAXIHPMX-RDJZCZTQSA-N 1 1 376.913 3.310 10 0 GGAEMO C[N@H+]1CC[C@H](NC(=O)N2CCc3ncsc3C2)[C@@H]1c1ccc(Cl)cc1 ZINC000372574441 565245412 /nfs/dbraw/zinc/24/54/12/565245412.db2.gz VNGVTCZAXIHPMX-RDJZCZTQSA-N 1 1 376.913 3.310 10 0 GGAEMO O=C(c1cc(Br)ccc1Br)N1CC[NH+](C2CC2)CC1 ZINC000160436952 565245941 /nfs/dbraw/zinc/24/59/41/565245941.db2.gz MWGLWNGJOFLQRH-UHFFFAOYSA-N 1 1 388.103 3.132 10 0 GGAEMO CNC(=O)[C@@H](C)Oc1ccc(Br)cc1C[NH2+]Cc1cnc(C)s1 ZINC000295154472 565247746 /nfs/dbraw/zinc/24/77/46/565247746.db2.gz JXPKDJKJQUEMLB-SNVBAGLBSA-N 1 1 398.326 3.017 10 0 GGAEMO Cc1nc([C@H]2CCCN2C(=O)NCC[N@@H+]2CCc3sccc3C2)cs1 ZINC000186383231 565258027 /nfs/dbraw/zinc/25/80/27/565258027.db2.gz GOHWRBHNZJCRKR-MRXNPFEDSA-N 1 1 376.551 3.418 10 0 GGAEMO Cc1nc([C@H]2CCCN2C(=O)NCC[N@H+]2CCc3sccc3C2)cs1 ZINC000186383231 565258035 /nfs/dbraw/zinc/25/80/35/565258035.db2.gz GOHWRBHNZJCRKR-MRXNPFEDSA-N 1 1 376.551 3.418 10 0 GGAEMO Fc1cc(C[NH2+]Cc2cccc(Br)c2F)cnc1N1CCOCC1 ZINC000295424732 565265621 /nfs/dbraw/zinc/26/56/21/565265621.db2.gz OEBALYTXTMECEY-UHFFFAOYSA-N 1 1 398.251 3.249 10 0 GGAEMO C[C@H]([NH2+]CCS(=O)(=O)c1ccccc1)c1nc2ccc(Cl)cc2n1C ZINC000271729216 565266402 /nfs/dbraw/zinc/26/64/02/565266402.db2.gz BURDWXKZXKDESI-ZDUSSCGKSA-N 1 1 377.897 3.351 10 0 GGAEMO COC[C@H](C)OC[C@@H](O)C[N@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000373181502 565274240 /nfs/dbraw/zinc/27/42/40/565274240.db2.gz UFXLQBXWZNRRBD-AVGNSLFASA-N 1 1 378.332 3.060 10 0 GGAEMO COc1cc(Br)ccc1CNC(=O)NC[C@H](C)Cn1cc[nH+]c1C ZINC000186703613 565279422 /nfs/dbraw/zinc/27/94/22/565279422.db2.gz SLGUXQTYKBMIEE-LBPRGKRZSA-N 1 1 395.301 3.098 10 0 GGAEMO COc1cc(Br)ccc1CNC(=O)NC[C@@H](C)Cn1cc[nH+]c1C ZINC000186703628 565279896 /nfs/dbraw/zinc/27/98/96/565279896.db2.gz SLGUXQTYKBMIEE-GFCCVEGCSA-N 1 1 395.301 3.098 10 0 GGAEMO C[N@H+](CC(=O)Nc1ccc(Br)c(C(F)(F)F)c1)CC1(CO)CC1 ZINC000186770005 565284241 /nfs/dbraw/zinc/28/42/41/565284241.db2.gz NRVFUHWBHITXIV-UHFFFAOYSA-N 1 1 395.219 3.111 10 0 GGAEMO C[N@@H+](CC(=O)Nc1ccc(Br)c(C(F)(F)F)c1)CC1(CO)CC1 ZINC000186770005 565284244 /nfs/dbraw/zinc/28/42/44/565284244.db2.gz NRVFUHWBHITXIV-UHFFFAOYSA-N 1 1 395.219 3.111 10 0 GGAEMO COc1c(Br)cccc1C[NH+]1CCC(C(=O)N2CCCC2)CC1 ZINC000186859153 565291270 /nfs/dbraw/zinc/29/12/70/565291270.db2.gz ANGSUOCFFZSVLH-UHFFFAOYSA-N 1 1 381.314 3.292 10 0 GGAEMO CCc1nn(C)c(Cl)c1C(=O)N[C@H]1CC[N@H+](C)[C@@H]1c1ccc(Cl)cc1 ZINC000161788082 565293868 /nfs/dbraw/zinc/29/38/68/565293868.db2.gz IOFPOFQXBXSAAY-GOEBONIOSA-N 1 1 381.307 3.465 10 0 GGAEMO CCc1nn(C)c(Cl)c1C(=O)N[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)cc1 ZINC000161788082 565293875 /nfs/dbraw/zinc/29/38/75/565293875.db2.gz IOFPOFQXBXSAAY-GOEBONIOSA-N 1 1 381.307 3.465 10 0 GGAEMO CC[N@H+]1CC[C@H](CNCc2cc(Br)cc(Br)c2N)C1 ZINC000187115300 565311175 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COc1ccc(OC)c(C[N@H+](CCO)Cc2cccc(Br)c2)c1 ZINC000303506455 565571638 /nfs/dbraw/zinc/57/16/38/565571638.db2.gz WAZOSKAUEVFGGX-UHFFFAOYSA-N 1 1 380.282 3.461 10 0 GGAEMO COc1ccc(OC)c(C[N@@H+](CCO)Cc2cccc(Br)c2)c1 ZINC000303506455 565571644 /nfs/dbraw/zinc/57/16/44/565571644.db2.gz WAZOSKAUEVFGGX-UHFFFAOYSA-N 1 1 380.282 3.461 10 0 GGAEMO Cc1ccc([C@H](C[NH2+]Cc2ncc(C(F)(F)F)s2)N2CCOCC2)o1 ZINC000278692742 565572754 /nfs/dbraw/zinc/57/27/54/565572754.db2.gz QDBRQRPKAWVALD-LBPRGKRZSA-N 1 1 375.416 3.226 10 0 GGAEMO Cc1oc(Br)cc1C(=O)NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000396748724 565573440 /nfs/dbraw/zinc/57/34/40/565573440.db2.gz RDPHPAHBVSGCBC-UHFFFAOYSA-N 1 1 393.281 3.113 10 0 GGAEMO CC[C@H](Cc1cccc(Br)c1)C(=O)NC[C@@H]1CCC[N@H+]1CCOC ZINC000303679877 565574252 /nfs/dbraw/zinc/57/42/52/565574252.db2.gz MBOSZSXXNSTVQZ-AEFFLSMTSA-N 1 1 397.357 3.245 10 0 GGAEMO C[C@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000173660441 565574455 /nfs/dbraw/zinc/57/44/55/565574455.db2.gz JPAUVNKFKXMLGQ-AAEUAGOBSA-N 1 1 378.270 3.190 10 0 GGAEMO C[C@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1ncc(-c2cccc(Br)c2)o1 ZINC000173660665 565574787 /nfs/dbraw/zinc/57/47/87/565574787.db2.gz WACHWZHZXKQZSM-AAEUAGOBSA-N 1 1 378.270 3.190 10 0 GGAEMO Cc1c(Br)c2ccccc2n1CC(=O)N(C)[C@H]1CCC[N@@H+](C)C1 ZINC000303906168 565575371 /nfs/dbraw/zinc/57/53/71/565575371.db2.gz LWHCAYZDHDJYCX-AWEZNQCLSA-N 1 1 378.314 3.265 10 0 GGAEMO Cn1ncc(Br)c1CNC[C@]1(C)CCC[N@H+]1Cc1ccccc1 ZINC000397911633 565576924 /nfs/dbraw/zinc/57/69/24/565576924.db2.gz IACAKCXSRDZFHB-SFHVURJKSA-N 1 1 377.330 3.327 10 0 GGAEMO Cn1ncc(Br)c1C[NH2+]C[C@]1(C)CCCN1Cc1ccccc1 ZINC000397911633 565576928 /nfs/dbraw/zinc/57/69/28/565576928.db2.gz IACAKCXSRDZFHB-SFHVURJKSA-N 1 1 377.330 3.327 10 0 GGAEMO CN(C(=O)c1cc(Br)cn1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000309804414 565578253 /nfs/dbraw/zinc/57/82/53/565578253.db2.gz TUHMWVOXDQRZQQ-INIZCTEOSA-N 1 1 376.298 3.134 10 0 GGAEMO C[C@H](c1nnc(-c2ccc(Cl)c(Cl)c2)o1)[N@H+]1CC[C@]2(CNC(=O)C2)C1 ZINC000278833856 565579901 /nfs/dbraw/zinc/57/99/01/565579901.db2.gz IPIQRURKKQRXFV-QGHHPUGFSA-N 1 1 381.263 3.316 10 0 GGAEMO CC[C@@H](NC(=O)N1CCC[N@H+](C2CC2)CC1)c1nc(C(F)(F)F)cs1 ZINC000173743118 565581605 /nfs/dbraw/zinc/58/16/05/565581605.db2.gz VYJPWPZEGPCZND-GFCCVEGCSA-N 1 1 376.448 3.493 10 0 GGAEMO CC(C)(C)c1nc2ccc(S(=O)(=O)N3CC[NH+]4CCC3CC4)cc2s1 ZINC000191084653 565582198 /nfs/dbraw/zinc/58/21/98/565582198.db2.gz QBKMOUCVZNHXGY-UHFFFAOYSA-N 1 1 379.551 3.063 10 0 GGAEMO COc1c(Br)c(C)sc1C(=O)N(C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000173749377 565583018 /nfs/dbraw/zinc/58/30/18/565583018.db2.gz CMXNKEMBSTWZDB-KOLCDFICSA-N 1 1 375.332 3.382 10 0 GGAEMO O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1nscc1Br ZINC000404887733 565583952 /nfs/dbraw/zinc/58/39/52/565583952.db2.gz GNYNIAKMBQFRGM-ZDUSSCGKSA-N 1 1 380.311 3.158 10 0 GGAEMO CN(C(=O)c1nscc1Br)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000404887142 565584179 /nfs/dbraw/zinc/58/41/79/565584179.db2.gz FYSICBAPLBZJBY-ZDUSSCGKSA-N 1 1 380.311 3.252 10 0 GGAEMO O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1nscc1Br ZINC000404887732 565584296 /nfs/dbraw/zinc/58/42/96/565584296.db2.gz GNYNIAKMBQFRGM-CYBMUJFWSA-N 1 1 380.311 3.158 10 0 GGAEMO CN(C(=O)c1nscc1Br)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000404887139 565584456 /nfs/dbraw/zinc/58/44/56/565584456.db2.gz FYSICBAPLBZJBY-CYBMUJFWSA-N 1 1 380.311 3.252 10 0 GGAEMO C[C@H]1[C@@H](NC(=O)c2nscc2Br)CC[N@H+]1Cc1ccccc1 ZINC000404939379 565584502 /nfs/dbraw/zinc/58/45/02/565584502.db2.gz LKIIDWPMOUFQJR-FZMZJTMJSA-N 1 1 380.311 3.298 10 0 GGAEMO C[C@H](c1nnc(-c2ccc(Cl)cc2Cl)o1)[N@H+]1CC[C@]2(CNC(=O)C2)C1 ZINC000278933348 565586285 /nfs/dbraw/zinc/58/62/85/565586285.db2.gz SYOKJCMQEKXZHI-QGHHPUGFSA-N 1 1 381.263 3.316 10 0 GGAEMO Cc1cnn(C)c1C[NH2+]Cc1cc(Cl)ccc1I ZINC000405815924 565587396 /nfs/dbraw/zinc/58/73/96/565587396.db2.gz VRACMPBZAZMUJA-UHFFFAOYSA-N 1 1 375.641 3.276 10 0 GGAEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1S(=O)(=O)c1ccc(C)cc1Br ZINC000173829630 565591360 /nfs/dbraw/zinc/59/13/60/565591360.db2.gz YYJSWMSYIRKFAL-UONOGXRCSA-N 1 1 387.343 3.005 10 0 GGAEMO C[C@H]1CN(C(=O)CCCSc2ccc(Cl)cc2)C[C@H]1[NH+]1CCOCC1 ZINC000173836401 565592318 /nfs/dbraw/zinc/59/23/18/565592318.db2.gz YEDHKLHKOBFAGV-MAUKXSAKSA-N 1 1 382.957 3.391 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1S(=O)(=O)Cc1ccc(Cl)c(Cl)c1 ZINC000173840844 565592538 /nfs/dbraw/zinc/59/25/38/565592538.db2.gz DIDYNWSEQVBAJQ-CQSZACIVSA-N 1 1 388.320 3.493 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1 ZINC000408190779 565597600 /nfs/dbraw/zinc/59/76/00/565597600.db2.gz AUJUZOMMPIMJHK-UHFFFAOYSA-N 1 1 390.328 3.041 10 0 GGAEMO Brc1ccc(-c2nc(C[N@@H+]3CC[C@H](N4CCOCC4)C3)co2)cc1 ZINC000173904883 565598061 /nfs/dbraw/zinc/59/80/61/565598061.db2.gz DURRYFSUBLHOLT-KRWDZBQOSA-N 1 1 392.297 3.011 10 0 GGAEMO Brc1ccc(-c2nc(C[N@H+]3CC[C@H](N4CCOCC4)C3)co2)cc1 ZINC000173904883 565598066 /nfs/dbraw/zinc/59/80/66/565598066.db2.gz DURRYFSUBLHOLT-KRWDZBQOSA-N 1 1 392.297 3.011 10 0 GGAEMO Brc1ccccc1-c1cnc(C[N@@H+]2CC[C@H](N3CCOCC3)C2)o1 ZINC000173904957 565598468 /nfs/dbraw/zinc/59/84/68/565598468.db2.gz HCQJHCYOAOUOPQ-AWEZNQCLSA-N 1 1 392.297 3.011 10 0 GGAEMO Brc1ccccc1-c1cnc(C[N@H+]2CC[C@H](N3CCOCC3)C2)o1 ZINC000173904957 565598473 /nfs/dbraw/zinc/59/84/73/565598473.db2.gz HCQJHCYOAOUOPQ-AWEZNQCLSA-N 1 1 392.297 3.011 10 0 GGAEMO C[C@H](O)C[N@H+]1CCN(C(=O)N[C@@H]2CCc3c2ccc(Cl)c3Cl)C[C@H]1C ZINC000408209889 565599072 /nfs/dbraw/zinc/59/90/72/565599072.db2.gz WSPZDXSLCJDRFQ-BFQNTYOBSA-N 1 1 386.323 3.077 10 0 GGAEMO C[C@@H]1[C@H](C)N(C(=O)Nc2cnn(-c3ncc(Cl)cc3Cl)c2)CC[N@@H+]1C ZINC000408209360 565599370 /nfs/dbraw/zinc/59/93/70/565599370.db2.gz ZXYYGNVUBYELFC-MNOVXSKESA-N 1 1 383.283 3.130 10 0 GGAEMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)C1(c2ccccc2Br)CC1 ZINC000191425450 565602268 /nfs/dbraw/zinc/60/22/68/565602268.db2.gz GUVCJRSVBYDDEB-CYBMUJFWSA-N 1 1 376.298 3.438 10 0 GGAEMO COc1cc(Br)ccc1[C@H](C)NC(=O)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000191456836 565605670 /nfs/dbraw/zinc/60/56/70/565605670.db2.gz OKYOLVPNMFWWKX-DZGCQCFKSA-N 1 1 396.329 3.398 10 0 GGAEMO CCOc1cc(CN2CC[C@H]3[C@H](CCC[N@H+]3C)C2)cc(Br)c1O ZINC000321827381 565606972 /nfs/dbraw/zinc/60/69/72/565606972.db2.gz BQKYAKRTTIIXMK-ZBFHGGJFSA-N 1 1 383.330 3.470 10 0 GGAEMO Cc1c(Br)cccc1CC(=O)N1CCC([N@@H+]2CCO[C@H](C)C2)CC1 ZINC000191516157 565609921 /nfs/dbraw/zinc/60/99/21/565609921.db2.gz RCKHEJMMEFRLLD-CQSZACIVSA-N 1 1 395.341 3.012 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(S(=O)(=O)c2ccc(C)c(Br)c2)CC1 ZINC000408462584 565610614 /nfs/dbraw/zinc/61/06/14/565610614.db2.gz ACBIUIZIKQXRHL-UHFFFAOYSA-N 1 1 398.326 3.288 10 0 GGAEMO O=C(C[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O)Nc1ccc(Br)cc1 ZINC000322656197 565610838 /nfs/dbraw/zinc/61/08/38/565610838.db2.gz ZJADWMRICATEQQ-ZACQAIPSSA-N 1 1 381.314 3.403 10 0 GGAEMO Cc1cccc(C[NH2+][C@@H](C)c2ccc(S(N)(=O)=O)cc2)c1Br ZINC000191542121 565611122 /nfs/dbraw/zinc/61/11/22/565611122.db2.gz GTSDDABTKUIGSX-LBPRGKRZSA-N 1 1 383.311 3.256 10 0 GGAEMO C[C@H](Cc1ccc(Br)cc1)NC(=O)N1CC[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000174075913 565611231 /nfs/dbraw/zinc/61/12/31/565611231.db2.gz JGGOZMIHIOZMHG-XYPHTWIQSA-N 1 1 380.330 3.258 10 0 GGAEMO Cc1cccc(C[NH2+][C@H](C)c2ccc(S(N)(=O)=O)cc2)c1Br ZINC000191542133 565611314 /nfs/dbraw/zinc/61/13/14/565611314.db2.gz GTSDDABTKUIGSX-GFCCVEGCSA-N 1 1 383.311 3.256 10 0 GGAEMO CC(C)OCC[NH+]1CCN(C(=O)N[C@@H](C)c2ccccc2Br)CC1 ZINC000174117158 565614379 /nfs/dbraw/zinc/61/43/79/565614379.db2.gz NKEKFUPMQQCQAM-HNNXBMFYSA-N 1 1 398.345 3.262 10 0 GGAEMO O=C(NC[C@@H]1CC[N@H+](C2CC2)C1)c1cc(F)c(Br)cc1Cl ZINC000279547495 565619031 /nfs/dbraw/zinc/61/90/31/565619031.db2.gz AIJCKORZNHFSEP-VIFPVBQESA-N 1 1 375.669 3.456 10 0 GGAEMO C[C@@H]1C[C@H](N(C)C(=O)NCCc2ccc(F)c(Br)c2)CC[N@H+]1C ZINC000174183147 565619171 /nfs/dbraw/zinc/61/91/71/565619171.db2.gz AYKHZXIPSMZLDU-TZMCWYRMSA-N 1 1 386.309 3.255 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)CC(=O)Nc2c(F)cc(F)cc2Br)CC[N@H+]1C ZINC000174173294 565619427 /nfs/dbraw/zinc/61/94/27/565619427.db2.gz UTKNNHHRIOCUDY-PWSUYJOCSA-N 1 1 390.272 3.080 10 0 GGAEMO C[C@H]1C[C@H](N(C)CC(=O)Nc2c(F)cc(F)cc2Br)CC[N@H+]1C ZINC000174173280 565619460 /nfs/dbraw/zinc/61/94/60/565619460.db2.gz UTKNNHHRIOCUDY-CMPLNLGQSA-N 1 1 390.272 3.080 10 0 GGAEMO C[C@@H](Oc1ccc(F)cc1Br)C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000174200141 565620493 /nfs/dbraw/zinc/62/04/93/565620493.db2.gz KFMWAQQQYMGKIX-JZIBPQBNSA-N 1 1 399.304 3.487 10 0 GGAEMO Cc1ccc(I)c(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1 ZINC000174222039 565621172 /nfs/dbraw/zinc/62/11/72/565621172.db2.gz MHWPGSFOHFBWPH-AGUYFDCRSA-N 1 1 398.288 3.345 10 0 GGAEMO C[C@H](Oc1cccc(Br)c1)C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000174234161 565622620 /nfs/dbraw/zinc/62/26/20/565622620.db2.gz UXBZXCOSKKASTJ-WWTUQBGBSA-N 1 1 381.314 3.348 10 0 GGAEMO COCC[N@@H+]1CCN(C(=O)c2cc(Br)cc(OC(C)C)c2)C[C@H]1C ZINC000174248043 565623963 /nfs/dbraw/zinc/62/39/63/565623963.db2.gz UBFXMYZPZDKFPC-CQSZACIVSA-N 1 1 399.329 3.029 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3.022 10 0 GGAEMO Cc1nc(C)c([C@H](C)[N@@H+](C)Cc2ccc(S(=O)(=O)NC3CC3)cc2)s1 ZINC000649522196 566371179 /nfs/dbraw/zinc/37/11/79/566371179.db2.gz NRXWAHKMVALPLE-ZDUSSCGKSA-N 1 1 379.551 3.394 10 0 GGAEMO Cc1c(Cl)cc(F)c(NC(=O)NCCCC[N@H+]2CCC[C@@H]2CO)c1F ZINC000536421791 566371559 /nfs/dbraw/zinc/37/15/59/566371559.db2.gz RRDNZTFEWXWCAC-GFCCVEGCSA-N 1 1 375.847 3.285 10 0 GGAEMO CS(=O)(=O)Nc1cccc(C[NH2+]Cc2cscc2Br)c1 ZINC000510241506 566371538 /nfs/dbraw/zinc/37/15/38/566371538.db2.gz NYUZACRQFFPPKK-UHFFFAOYSA-N 1 1 375.313 3.172 10 0 GGAEMO C[C@H]1OCC[C@@H]1[N@H+](CCO)Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000483292437 566371815 /nfs/dbraw/zinc/37/18/15/566371815.db2.gz GDKNQHUGSCWGCQ-DOMZBBRYSA-N 1 1 381.270 3.076 10 0 GGAEMO C[C@H]1OCC[C@@H]1[N@@H+](CCO)Cc1ncc(-c2ccc(Br)cc2)o1 ZINC000483292437 566371817 /nfs/dbraw/zinc/37/18/17/566371817.db2.gz GDKNQHUGSCWGCQ-DOMZBBRYSA-N 1 1 381.270 3.076 10 0 GGAEMO CC(C)C[N@H+]1CCO[C@@H](CNC(=O)CSCc2cccc(F)c2Cl)C1 ZINC000557197763 566372866 /nfs/dbraw/zinc/37/28/66/566372866.db2.gz SWUDHVSFIIHNPK-HNNXBMFYSA-N 1 1 388.936 3.185 10 0 GGAEMO CC(C)[N@H+](Cc1cnc(-c2ccc(Br)cc2)s1)C[C@@H](O)CO ZINC000421408059 566372902 /nfs/dbraw/zinc/37/29/02/566372902.db2.gz JYGOBZHJFSNDNV-CQSZACIVSA-N 1 1 385.327 3.136 10 0 GGAEMO CN(C)C[C@H]([NH2+]CC(=O)N(C)c1nccs1)c1ccc(Cl)c(Cl)c1 ZINC000625983723 566373154 /nfs/dbraw/zinc/37/31/54/566373154.db2.gz YVUOEUVXPWUMFN-AWEZNQCLSA-N 1 1 387.336 3.305 10 0 GGAEMO Cc1n[nH]c(C)c1NC(=O)C[NH2+][C@@H](CN(C)C)c1ccc(Cl)c(Cl)c1 ZINC000625983662 566373263 /nfs/dbraw/zinc/37/32/63/566373263.db2.gz XBXQOWLUHKFPST-HNNXBMFYSA-N 1 1 384.311 3.164 10 0 GGAEMO O=S(=O)(NC1CC1)c1ccc(C[N@@H+](CCC(F)(F)F)CC2CC2)cc1 ZINC000649549958 566373445 /nfs/dbraw/zinc/37/34/45/566373445.db2.gz YDCLGDSEPBZKPZ-UHFFFAOYSA-N 1 1 376.444 3.292 10 0 GGAEMO Cc1cc(C)c(C[S@](=O)Cc2cc(=O)n3cc(Cl)ccc3n2)c(C)[nH+]1 ZINC000600898955 566373635 /nfs/dbraw/zinc/37/36/35/566373635.db2.gz DEEZCOVWVNNUBD-RUZDIDTESA-N 1 1 375.881 3.117 10 0 GGAEMO O=c1ccc([C@@H]2CCC[N@@H+]2C[C@@H](O)COc2ccc(Cl)c(Cl)c2)n[nH]1 ZINC000625995799 566373701 /nfs/dbraw/zinc/37/37/01/566373701.db2.gz WAHOXKZZPZAVBB-BZNIZROVSA-N 1 1 384.263 3.066 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CCC(=O)N1CCOc2ccc(Br)cc2C1 ZINC000510295164 566373873 /nfs/dbraw/zinc/37/38/73/566373873.db2.gz LDSFFFXVTZUXDB-INIZCTEOSA-N 1 1 381.314 3.435 10 0 GGAEMO Cc1cc(Br)ccc1[C@H]1CCC[N@H+]1CCC(=O)N1CCOCC1 ZINC000626009499 566374062 /nfs/dbraw/zinc/37/40/62/566374062.db2.gz KJFNPQODGOSVSG-QGZVFWFLSA-N 1 1 381.314 3.143 10 0 GGAEMO Cc1cc(Br)ccc1[C@H]1CCC[N@H+]1CCN1C(=O)NC(C)(C)C1=O ZINC000626009548 566374278 /nfs/dbraw/zinc/37/42/78/566374278.db2.gz LQFCCAYICMLWDG-OAHLLOKOSA-N 1 1 394.313 3.225 10 0 GGAEMO Cc1cc(Br)ccc1[C@@H]1CCC[N@H+]1CCN1C(=O)NC(C)(C)C1=O ZINC000626009547 566374829 /nfs/dbraw/zinc/37/48/29/566374829.db2.gz LQFCCAYICMLWDG-HNNXBMFYSA-N 1 1 394.313 3.225 10 0 GGAEMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@@H+]1Cc1ccc(S(=O)(=O)NC2CC2)cc1 ZINC000649579564 566374980 /nfs/dbraw/zinc/37/49/80/566374980.db2.gz CQJLTFGJNPMEJB-TZMCWYRMSA-N 1 1 376.444 3.290 10 0 GGAEMO C[C@@H]1CC[C@@H](C(F)(F)F)C[N@H+]1Cc1ccc(S(=O)(=O)NC2CC2)cc1 ZINC000649579564 566374990 /nfs/dbraw/zinc/37/49/90/566374990.db2.gz CQJLTFGJNPMEJB-TZMCWYRMSA-N 1 1 376.444 3.290 10 0 GGAEMO C[C@H]1CC[C@H](C(F)(F)F)C[N@@H+]1Cc1ccc(S(=O)(=O)NC2CC2)cc1 ZINC000649579562 566375578 /nfs/dbraw/zinc/37/55/78/566375578.db2.gz CQJLTFGJNPMEJB-JSGCOSHPSA-N 1 1 376.444 3.290 10 0 GGAEMO C[C@H]1CC[C@H](C(F)(F)F)C[N@H+]1Cc1ccc(S(=O)(=O)NC2CC2)cc1 ZINC000649579562 566375586 /nfs/dbraw/zinc/37/55/86/566375586.db2.gz CQJLTFGJNPMEJB-JSGCOSHPSA-N 1 1 376.444 3.290 10 0 GGAEMO Cc1cc(Br)ccc1[C@H]1CCC[N@@H+]1Cc1cc(=O)n2nccc2[nH]1 ZINC000626010459 566376909 /nfs/dbraw/zinc/37/69/09/566376909.db2.gz RXVVBSBWVNPWPZ-MRXNPFEDSA-N 1 1 387.281 3.431 10 0 GGAEMO Cc1cc(Br)ccc1[C@H]1CCC[N@H+]1Cc1cc(=O)n2nccc2[nH]1 ZINC000626010459 566376911 /nfs/dbraw/zinc/37/69/11/566376911.db2.gz RXVVBSBWVNPWPZ-MRXNPFEDSA-N 1 1 387.281 3.431 10 0 GGAEMO C[C@H]1C[C@@H](c2ccc(Br)cc2)C[N@H+]1Cc1cc(=O)n2nccc2[nH]1 ZINC000626040726 566377857 /nfs/dbraw/zinc/37/78/57/566377857.db2.gz KVLCFIYLSAWGGT-GXTWGEPZSA-N 1 1 387.281 3.163 10 0 GGAEMO COCCc1nc(C[N@@H+]2C[C@@H](c3ccc(Br)cc3)C[C@H]2C)no1 ZINC000626041284 566378662 /nfs/dbraw/zinc/37/86/62/566378662.db2.gz UFCXYLYRXIUJGC-OCCSQVGLSA-N 1 1 380.286 3.399 10 0 GGAEMO COCCc1nc(C[N@H+]2C[C@@H](c3ccc(Br)cc3)C[C@H]2C)no1 ZINC000626041284 566378665 /nfs/dbraw/zinc/37/86/65/566378665.db2.gz UFCXYLYRXIUJGC-OCCSQVGLSA-N 1 1 380.286 3.399 10 0 GGAEMO COC[C@H](C)OC[C@H](O)C[N@H+]1C[C@@H](c2ccc(Br)cc2)C[C@H]1C ZINC000626040691 566378717 /nfs/dbraw/zinc/37/87/17/566378717.db2.gz KIRMZFDXNWQQES-YQYZPQCESA-N 1 1 386.330 3.039 10 0 GGAEMO C[C@H]1C[C@@H](c2ccc(Br)cc2)C[N@H+]1CC(=O)NCc1cccnc1 ZINC000626041093 566378963 /nfs/dbraw/zinc/37/89/63/566378963.db2.gz QNEYNGDUROGBCV-WMLDXEAASA-N 1 1 388.309 3.338 10 0 GGAEMO Cc1cc(C)c(C[S@](=O)CC(=O)N2CCC[C@@H](C(F)(F)F)C2)c(C)[nH+]1 ZINC000600933427 566379001 /nfs/dbraw/zinc/37/90/01/566379001.db2.gz DJPVSJKOHNJNLF-PWECECGKSA-N 1 1 376.444 3.056 10 0 GGAEMO C[C@H](C(=O)Nc1ncccn1)[N@H+]1C[C@H](c2ccc(Br)cc2)C[C@H]1C ZINC000626040950 566379100 /nfs/dbraw/zinc/37/91/00/566379100.db2.gz OMHOUAFAETVKPQ-UMVBOHGHSA-N 1 1 389.297 3.444 10 0 GGAEMO Cc1cc(C)c(C[S@](=O)CC(=O)N2CCC[C@H](C(F)(F)F)C2)c(C)[nH+]1 ZINC000600933428 566379361 /nfs/dbraw/zinc/37/93/61/566379361.db2.gz DJPVSJKOHNJNLF-SXBQZSJRSA-N 1 1 376.444 3.056 10 0 GGAEMO C[C@@H]1C[C@@H](c2ccc(Br)cc2)C[N@H+]1C[C@H]1CCCS(=O)(=O)C1 ZINC000626041334 566380403 /nfs/dbraw/zinc/38/04/03/566380403.db2.gz VRIPBHBCYSMMSY-IIAWOOMASA-N 1 1 386.355 3.452 10 0 GGAEMO CNC(=O)C[C@H]([NH2+]CC(=O)Nc1c(Cl)cccc1Cl)c1ccccc1 ZINC000483409511 566380416 /nfs/dbraw/zinc/38/04/16/566380416.db2.gz UEUOOVIQERIESX-HNNXBMFYSA-N 1 1 380.275 3.399 10 0 GGAEMO Cc1cc(C)c(C[S@@](=O)CC(=O)NCCc2ccc(Cl)cc2)c(C)[nH+]1 ZINC000600934400 566380616 /nfs/dbraw/zinc/38/06/16/566380616.db2.gz IEXXJYRCFCHGLF-RUZDIDTESA-N 1 1 378.925 3.268 10 0 GGAEMO Cc1cc(NC(=O)C[NH2+]C2(c3ccccc3Br)CCC2)n(C)n1 ZINC000649646917 566381955 /nfs/dbraw/zinc/38/19/55/566381955.db2.gz WEWWPLVKQCDZJY-UHFFFAOYSA-N 1 1 377.286 3.099 10 0 GGAEMO Cc1n[nH]c(C)c1NC(=O)C[NH2+]C1(c2ccccc2Br)CCC1 ZINC000649645873 566381982 /nfs/dbraw/zinc/38/19/82/566381982.db2.gz LKMJXQQKZAHVOP-UHFFFAOYSA-N 1 1 377.286 3.397 10 0 GGAEMO FCCC[NH+]1CCN(Cc2nc(-c3cc(Br)cs3)no2)CC1 ZINC000626071985 566382670 /nfs/dbraw/zinc/38/26/70/566382670.db2.gz BXJCBQYNRMJBRM-UHFFFAOYSA-N 1 1 389.294 3.038 10 0 GGAEMO C[C@H](NC(=O)CC(C)(C)C)C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000510445176 566383210 /nfs/dbraw/zinc/38/32/10/566383210.db2.gz ZECAGSDXRZAODS-LBPRGKRZSA-N 1 1 398.345 3.390 10 0 GGAEMO COc1cc(C)nc(C[NH2+][C@H]2CCN(c3cccc(Br)c3)C2=O)c1 ZINC000447062316 566383533 /nfs/dbraw/zinc/38/35/33/566383533.db2.gz YYVSRADMRTUMAC-KRWDZBQOSA-N 1 1 390.281 3.056 10 0 GGAEMO CN(C)S(=O)(=O)c1ccc(C[N@@H+]2CC[C@](C)(c3cccc(F)c3)C2)s1 ZINC000649662139 566383934 /nfs/dbraw/zinc/38/39/34/566383934.db2.gz WXVBSZAUBRBLNU-SFHVURJKSA-N 1 1 382.526 3.301 10 0 GGAEMO CN(C)S(=O)(=O)c1ccc(C[N@H+]2CC[C@](C)(c3cccc(F)c3)C2)s1 ZINC000649662139 566383940 /nfs/dbraw/zinc/38/39/40/566383940.db2.gz WXVBSZAUBRBLNU-SFHVURJKSA-N 1 1 382.526 3.301 10 0 GGAEMO C[C@]1(c2cccc(F)c2)CC[N@H+](Cc2cc(Cl)cc(S(N)(=O)=O)c2)C1 ZINC000649662341 566384316 /nfs/dbraw/zinc/38/43/16/566384316.db2.gz AQMFJWQBBNWQCG-SFHVURJKSA-N 1 1 382.888 3.290 10 0 GGAEMO C[C@]1(c2cccc(F)c2)CC[N@@H+](Cc2cc(Cl)cc(S(N)(=O)=O)c2)C1 ZINC000649662341 566384328 /nfs/dbraw/zinc/38/43/28/566384328.db2.gz AQMFJWQBBNWQCG-SFHVURJKSA-N 1 1 382.888 3.290 10 0 GGAEMO CCn1c(C[NH2+]Cc2ccc3c(c2)nnn3C)nc2cc(Br)ccc21 ZINC000483488240 566385549 /nfs/dbraw/zinc/38/55/49/566385549.db2.gz HKHNYNVSYXLBCZ-UHFFFAOYSA-N 1 1 399.296 3.390 10 0 GGAEMO C[C@@H]1C[C@H](CO)CC[N@H+]1Cc1ccnc(-c2ccc(Br)cc2)n1 ZINC000626120270 566386534 /nfs/dbraw/zinc/38/65/34/566386534.db2.gz YFIYSBDTFOSAJY-ZIAGYGMSSA-N 1 1 376.298 3.499 10 0 GGAEMO CCn1c(C[NH2+]Cc2c(C)nn(C)c2C)nc2cc(Br)ccc21 ZINC000483494381 566387338 /nfs/dbraw/zinc/38/73/38/566387338.db2.gz UMFXRESTYUTFFA-UHFFFAOYSA-N 1 1 376.302 3.459 10 0 GGAEMO C[C@H](NC(=O)N[C@@H]1CCc2cc(Br)ccc21)C1=CC[N@@H+](C)CC1 ZINC000510498553 566387775 /nfs/dbraw/zinc/38/77/75/566387775.db2.gz CBESGUVJGJFLCP-YVEFUNNKSA-N 1 1 378.314 3.386 10 0 GGAEMO C[N@H+]1CCC[C@@H]2CN(C(=O)[C@@H]3[C@@H]4Cc5c(cccc5Br)[C@@H]43)CC[C@@H]21 ZINC000626155198 566388955 /nfs/dbraw/zinc/38/89/55/566388955.db2.gz HZXQOHXYDPNOGF-LCSDLDFTSA-N 1 1 389.337 3.278 10 0 GGAEMO CCn1c(C[NH2+]Cc2ccc(C(=O)OC)[nH]2)nc2cc(Br)ccc21 ZINC000483509399 566389312 /nfs/dbraw/zinc/38/93/12/566389312.db2.gz NKSLRAPHZBJUNF-UHFFFAOYSA-N 1 1 391.269 3.223 10 0 GGAEMO C[C@@H](CC(=O)NCC[NH+]1CCN(c2cccc(Cl)c2)CC1)C(F)(F)F ZINC000626165613 566389579 /nfs/dbraw/zinc/38/95/79/566389579.db2.gz BCCXIXXDDGBFAF-ZDUSSCGKSA-N 1 1 377.838 3.167 10 0 GGAEMO Cc1noc([C@H]2OCC[C@H]2[NH2+][C@@H](C)C(=O)Nc2ccc(Cl)cc2Cl)n1 ZINC000626144274 566389735 /nfs/dbraw/zinc/38/97/35/566389735.db2.gz AGQPELQSJYTPQU-PCTYZZJISA-N 1 1 385.251 3.132 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)C(=O)[C@@H]2CCOc3ccc(Br)cc32)CC[N@H+]1C ZINC000649765567 566390467 /nfs/dbraw/zinc/39/04/67/566390467.db2.gz ZTGZDRLMPPVUIZ-VHDGCEQUSA-N 1 1 381.314 3.256 10 0 GGAEMO CC[C@@H](c1ccc(Br)cc1)[N@H+]1CCC[C@H](CS(=O)(=O)NC)C1 ZINC000626167820 566392131 /nfs/dbraw/zinc/39/21/31/566392131.db2.gz DEIQRTOVHOREKZ-BBRMVZONSA-N 1 1 389.359 3.161 10 0 GGAEMO C[C@@H](C(=O)Nc1ccc(Cl)c(Cl)c1)[NH+]1CCC(Cn2cnnc2)CC1 ZINC000649786182 566392474 /nfs/dbraw/zinc/39/24/74/566392474.db2.gz DWIRFWVABQUWIZ-LBPRGKRZSA-N 1 1 382.295 3.324 10 0 GGAEMO C[C@H](CO)C1CC[NH+](Cc2nnc(-c3ccccc3Br)o2)CC1 ZINC000649804533 566394488 /nfs/dbraw/zinc/39/44/88/566394488.db2.gz AUEHVJOCTVVMCK-GFCCVEGCSA-N 1 1 380.286 3.340 10 0 GGAEMO C[C@@H](CO)C1CC[NH+](Cc2nnc(-c3ccccc3Br)o2)CC1 ZINC000649804534 566394524 /nfs/dbraw/zinc/39/45/24/566394524.db2.gz AUEHVJOCTVVMCK-LBPRGKRZSA-N 1 1 380.286 3.340 10 0 GGAEMO CC(C)[N@@H+](C[C@@H](O)COc1ccc(Cl)cc1Br)[C@@H]1CCOC1 ZINC000463228593 566394470 /nfs/dbraw/zinc/39/44/70/566394470.db2.gz CULMLHBCWRYSLM-ZIAGYGMSSA-N 1 1 392.721 3.342 10 0 GGAEMO C[C@@H](Cc1ccc(O)cc1)[N@@H+](C)C[C@@H](O)COc1ccc(Br)cc1 ZINC000483645236 566395613 /nfs/dbraw/zinc/39/56/13/566395613.db2.gz GBKCTMKDQSBYGK-KBXCAEBGSA-N 1 1 394.309 3.457 10 0 GGAEMO Cc1[nH+]ccn1CCCN(C)C(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000626224418 566395995 /nfs/dbraw/zinc/39/59/95/566395995.db2.gz UMNFJKOJFONYRS-BPQIPLTHSA-N 1 1 388.309 3.388 10 0 GGAEMO C[C@@H](Cc1cccc(Br)c1)NC(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000601281127 566398702 /nfs/dbraw/zinc/39/87/02/566398702.db2.gz ZKAGXCWFQQVFOH-GUYCJALGSA-N 1 1 380.330 3.258 10 0 GGAEMO CC[N@H+]1C[C@H](C)N(C(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)C[C@@H]1C ZINC000626314995 566400828 /nfs/dbraw/zinc/40/08/28/566400828.db2.gz XPIHDWVRJVOPNU-WJPHHUGGSA-N 1 1 377.326 3.276 10 0 GGAEMO 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JDJBBZDJBDEDOV-UHFFFAOYSA-N 1 1 390.281 3.483 10 0 GGAEMO Cc1ccc(CN2CCN(C[C@@H]3CCCC[N@@H+]3C)CC2)cc1Br ZINC000513707432 566617767 /nfs/dbraw/zinc/61/77/67/566617767.db2.gz CUKLNOGKFJURGM-SFHVURJKSA-N 1 1 380.374 3.359 10 0 GGAEMO C[C@@H](NC(=O)c1ccsc1Br)C1([NH+]2CCOCC2)CCCC1 ZINC000449948625 566618048 /nfs/dbraw/zinc/61/80/48/566618048.db2.gz ATDQGVBXNKFKDF-GFCCVEGCSA-N 1 1 387.343 3.274 10 0 GGAEMO NS(=O)(=O)C[C@@H]1CCC[N@H+]1Cc1cccc(Oc2ccc(Cl)cc2)c1 ZINC000674908989 566618277 /nfs/dbraw/zinc/61/82/77/566618277.db2.gz VONBKAFUYLAGIE-INIZCTEOSA-N 1 1 380.897 3.385 10 0 GGAEMO COC(=O)c1ccc(C(=O)Nc2ccc(C[NH+](C)C)c(Br)c2)o1 ZINC000467041184 566619932 /nfs/dbraw/zinc/61/99/32/566619932.db2.gz RBWXMHGQGVDIOS-UHFFFAOYSA-N 1 1 381.226 3.143 10 0 GGAEMO C[C@@H]1C[N@@H+](CCCOc2cccc(I)c2)[C@H](C)CO1 ZINC000513716720 566620012 /nfs/dbraw/zinc/62/00/12/566620012.db2.gz HEHWCOAKLZPJLE-CHWSQXEVSA-N 1 1 375.250 3.169 10 0 GGAEMO Cc1csc(=O)n1CCC(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000467036009 566620169 /nfs/dbraw/zinc/62/01/69/566620169.db2.gz QYPYHOOYKBGSDL-UHFFFAOYSA-N 1 1 398.326 3.071 10 0 GGAEMO O=C(N[C@@H]1CC[N@@H+](CC2CC2)C1)N1CCc2cccc(Br)c2C1 ZINC000605882988 566620660 /nfs/dbraw/zinc/62/06/60/566620660.db2.gz OKKUHRGWVLXRKU-OAHLLOKOSA-N 1 1 378.314 3.001 10 0 GGAEMO CNS(=O)(=O)CCC[N@@H+](Cc1ccccc1Br)C1CCCC1 ZINC000486789648 566622290 /nfs/dbraw/zinc/62/22/90/566622290.db2.gz BBSATSZTHXKHOO-UHFFFAOYSA-N 1 1 389.359 3.133 10 0 GGAEMO C[C@H](OC[C@@H]1CCCCO1)C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000467065219 566622686 /nfs/dbraw/zinc/62/26/86/566622686.db2.gz YKCQMAULGLJRBA-BBRMVZONSA-N 1 1 399.329 3.423 10 0 GGAEMO Cc1ccn2ncc(C(=O)Nc3ccc(C[NH+](C)C)c(Br)c3)c2n1 ZINC000467074768 566624212 /nfs/dbraw/zinc/62/42/12/566624212.db2.gz MJGNXARDIKKYHV-UHFFFAOYSA-N 1 1 388.269 3.114 10 0 GGAEMO Cc1nc(C(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)c(Br)s1 ZINC000579603389 566624491 /nfs/dbraw/zinc/62/44/91/566624491.db2.gz TWVHDHLJLADBNI-JSGCOSHPSA-N 1 1 380.311 3.389 10 0 GGAEMO CCN(CC)C(=O)CCCC(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000467077305 566624556 /nfs/dbraw/zinc/62/45/56/566624556.db2.gz AZDHAOAMKRDZOV-UHFFFAOYSA-N 1 1 398.345 3.488 10 0 GGAEMO CC[C@H](Cc1ccccc1Br)C(=O)NC[C@H]1CCC[N@H+]1CCOC ZINC000467097932 566625143 /nfs/dbraw/zinc/62/51/43/566625143.db2.gz TVDRZCKZKPTQEE-NVXWUHKLSA-N 1 1 397.357 3.245 10 0 GGAEMO COCc1cnc(C[NH2+][C@@H]2CC(=O)N(C)[C@H]2c2ccc(Cl)c(F)c2)s1 ZINC000540067837 566625565 /nfs/dbraw/zinc/62/55/65/566625565.db2.gz YSCOHFQVEDGVHL-PBHICJAKSA-N 1 1 383.876 3.144 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)CCOC[C@H]2CCCO2)cc1Br ZINC000467084194 566626082 /nfs/dbraw/zinc/62/60/82/566626082.db2.gz XGGPIURBPWRGPV-OAHLLOKOSA-N 1 1 385.302 3.035 10 0 GGAEMO C[C@H](C[NH+]1CCOCC1)C(=O)N1C[C@H](c2ccc(Br)cc2)C[C@H]1C ZINC000629245322 566626875 /nfs/dbraw/zinc/62/68/75/566626875.db2.gz JLDAUYKQYZZNRO-BFYDXBDKSA-N 1 1 395.341 3.122 10 0 GGAEMO CC(C)[N@H+]1CC[C@H](CNC(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C1 ZINC000606358423 566628056 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GGAEMO C[C@H](CNC(=O)c1cc(Br)cc2ccccc21)C[NH+]1CCOCC1 ZINC000606422065 566631323 /nfs/dbraw/zinc/63/13/23/566631323.db2.gz OXAARKIHRAVNRS-CQSZACIVSA-N 1 1 391.309 3.300 10 0 GGAEMO Cc1cccc(NC(=O)C(=O)Nc2ccc(C[NH+](C)C)c(Br)c2)c1 ZINC000467180224 566631905 /nfs/dbraw/zinc/63/19/05/566631905.db2.gz FFBYPJXUOYPKQY-UHFFFAOYSA-N 1 1 390.281 3.396 10 0 GGAEMO CS(=O)(=O)N1CC[C@@H](C[N@H+]2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)C1 ZINC000513883002 566632318 /nfs/dbraw/zinc/63/23/18/566632318.db2.gz UPKHKPDTHGAUMQ-BLLLJJGKSA-N 1 1 377.337 3.412 10 0 GGAEMO CC[N@@H+](C[C@H]1CCN(S(C)(=O)=O)C1)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000513893376 566632905 /nfs/dbraw/zinc/63/29/05/566632905.db2.gz RYJHYOJZLPWDDL-ZIAGYGMSSA-N 1 1 378.460 3.370 10 0 GGAEMO COc1ccc([C@H](CNCc2c(Br)cnn2C)[NH+]2CCCC2)cc1 ZINC000486934647 566636402 /nfs/dbraw/zinc/63/64/02/566636402.db2.gz ZAFOEPTXPSRCIP-KRWDZBQOSA-N 1 1 393.329 3.118 10 0 GGAEMO C[C@H](C(=O)Nc1cnc2c(Br)cccn12)[N@@H+]1CCc2ccccc2C1 ZINC000560559271 566636840 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COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000467289731 566638728 /nfs/dbraw/zinc/63/87/28/566638728.db2.gz DUPFOZUSZOEPFW-GDLHICMESA-N 1 1 388.291 3.007 10 0 GGAEMO COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1C[C@@H](O)COc1ccc(Cl)cc1Cl ZINC000467289731 566638730 /nfs/dbraw/zinc/63/87/30/566638730.db2.gz DUPFOZUSZOEPFW-GDLHICMESA-N 1 1 388.291 3.007 10 0 GGAEMO COCC[C@H]1CCCC[N@@H+](C[C@@H](O)COc2ccc(Br)cc2)C1 ZINC000467272318 566638941 /nfs/dbraw/zinc/63/89/41/566638941.db2.gz AZBHDRJTBYSYKZ-NVXWUHKLSA-N 1 1 386.330 3.327 10 0 GGAEMO COCC[C@H]1CCCC[N@@H+](C[C@H](O)COc2ccc(Br)cc2)C1 ZINC000467272320 566638996 /nfs/dbraw/zinc/63/89/96/566638996.db2.gz AZBHDRJTBYSYKZ-WBVHZDCISA-N 1 1 386.330 3.327 10 0 GGAEMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)c1c(Cl)cc(F)cc1Br ZINC000450151179 566640026 /nfs/dbraw/zinc/64/00/26/566640026.db2.gz GGRNDDWEAUAFDP-ISVAXAHUSA-N 1 1 375.669 3.454 10 0 GGAEMO COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1C[C@@H](O)COc1cc(Cl)ccc1Cl 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C[C@@H]1C[N@H+](Cc2ccc(-c3cccc(Br)c3)o2)CCN1CCO ZINC000428461007 566845464 /nfs/dbraw/zinc/84/54/64/566845464.db2.gz OGIPIWMRWOVKOJ-CQSZACIVSA-N 1 1 379.298 3.208 10 0 GGAEMO C[C@@H]1C[N@@H+](Cc2ccc(-c3cccc(Br)c3)o2)CCN1CCO ZINC000428461007 566845468 /nfs/dbraw/zinc/84/54/68/566845468.db2.gz OGIPIWMRWOVKOJ-CQSZACIVSA-N 1 1 379.298 3.208 10 0 GGAEMO CSc1ccc([C@@H](CNS(=O)(=O)C[C@@H]2CCCC2(F)F)[NH+](C)C)cc1 ZINC000451592978 566846817 /nfs/dbraw/zinc/84/68/17/566846817.db2.gz PXJRSFJBKSRWFG-GOEBONIOSA-N 1 1 392.537 3.366 10 0 GGAEMO Cc1nn(-c2ccccc2Br)cc1C[NH2+][C@H]1CCc2[nH]cnc2C1 ZINC000655775629 566846893 /nfs/dbraw/zinc/84/68/93/566846893.db2.gz AWEUCLRQGBDKEU-AWEZNQCLSA-N 1 1 386.297 3.313 10 0 GGAEMO CSc1ccc([C@H](CNS(=O)(=O)C[C@H]2CCCC2(F)F)[NH+](C)C)cc1 ZINC000451593441 566846873 /nfs/dbraw/zinc/84/68/73/566846873.db2.gz PXJRSFJBKSRWFG-ZBFHGGJFSA-N 1 1 392.537 3.366 10 0 GGAEMO C[C@H](Cc1[nH]cc[nH+]1)OCCCOc1cccc(I)c1 ZINC000543030277 566847419 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Cc1nc(-c2cccc(NC(=O)CSC[C@H]3C[N@H+](C)CCO3)c2)cs1 ZINC000563118625 566856738 /nfs/dbraw/zinc/85/67/38/566856738.db2.gz FESYHHSFEKSDSR-MRXNPFEDSA-N 1 1 377.535 3.121 10 0 GGAEMO Cc1nc(-c2cccc(NC(=O)CSC[C@H]3C[N@@H+](C)CCO3)c2)cs1 ZINC000563118625 566856743 /nfs/dbraw/zinc/85/67/43/566856743.db2.gz FESYHHSFEKSDSR-MRXNPFEDSA-N 1 1 377.535 3.121 10 0 GGAEMO CC(C)OCC[NH+]1CCN(C(=O)C(C)(C)c2cccc(Br)c2)CC1 ZINC000470223239 566858787 /nfs/dbraw/zinc/85/87/87/566858787.db2.gz MDNTVWAZRZQMSA-UHFFFAOYSA-N 1 1 397.357 3.296 10 0 GGAEMO O[C@H](COC[C@H]1CCCO1)C[N@H+]1CCC[C@H]1c1ccc(Br)s1 ZINC000543176824 566859987 /nfs/dbraw/zinc/85/99/87/566859987.db2.gz MIXSCPBMMBXNPN-MJBXVCDLSA-N 1 1 390.343 3.204 10 0 GGAEMO O[C@@H]1C[C@H]([C@H]2CCCOC2)[N@H+](Cc2cc(Br)cc(F)c2F)C1 ZINC000582423489 566861305 /nfs/dbraw/zinc/86/13/05/566861305.db2.gz AEUMOYMVVKBHQY-PSOPSSQASA-N 1 1 376.241 3.089 10 0 GGAEMO O[C@@H]1C[C@H]([C@H]2CCCOC2)[N@@H+](Cc2cc(Br)cc(F)c2F)C1 ZINC000582423489 566861315 /nfs/dbraw/zinc/86/13/15/566861315.db2.gz AEUMOYMVVKBHQY-PSOPSSQASA-N 1 1 376.241 3.089 10 0 GGAEMO COc1ccccc1[C@H]([NH3+])C(=O)N[C@H](C)c1ccc(Br)cc1OC ZINC000563161222 566861298 /nfs/dbraw/zinc/86/12/98/566861298.db2.gz UXMQHKCPTSLVGT-DIFFPNOSSA-N 1 1 393.281 3.344 10 0 GGAEMO O[C@@H]1C[C@H]([C@@H]2CCCOC2)[N@H+](Cc2cc(Br)cc(F)c2F)C1 ZINC000582423490 566861578 /nfs/dbraw/zinc/86/15/78/566861578.db2.gz AEUMOYMVVKBHQY-WDBKCZKBSA-N 1 1 376.241 3.089 10 0 GGAEMO O[C@@H]1C[C@H]([C@@H]2CCCOC2)[N@@H+](Cc2cc(Br)cc(F)c2F)C1 ZINC000582423490 566861583 /nfs/dbraw/zinc/86/15/83/566861583.db2.gz AEUMOYMVVKBHQY-WDBKCZKBSA-N 1 1 376.241 3.089 10 0 GGAEMO O[C@@H]1C[C@@H]([C@@H]2CCCOC2)[N@H+](Cc2cc(Br)cc(F)c2F)C1 ZINC000582423491 566861708 /nfs/dbraw/zinc/86/17/08/566861708.db2.gz AEUMOYMVVKBHQY-YVLXSGLVSA-N 1 1 376.241 3.089 10 0 GGAEMO O[C@@H]1C[C@@H]([C@@H]2CCCOC2)[N@@H+](Cc2cc(Br)cc(F)c2F)C1 ZINC000582423491 566861717 /nfs/dbraw/zinc/86/17/17/566861717.db2.gz AEUMOYMVVKBHQY-YVLXSGLVSA-N 1 1 376.241 3.089 10 0 GGAEMO COC(=O)[C@@H](c1cc(Cl)cc(Cl)c1)N1CC[NH+](C[C@@H]2CCCO2)CC1 ZINC000610787111 566864107 /nfs/dbraw/zinc/86/41/07/566864107.db2.gz YZTUWBUEDUAHFA-DLBZAZTESA-N 1 1 387.307 3.004 10 0 GGAEMO O=C(CC[N@@H+]1CCC[C@@H](OC(F)F)C1)Nc1cccc(Br)c1 ZINC000679678123 566865815 /nfs/dbraw/zinc/86/58/15/566865815.db2.gz JNSFGYAOJZBWAS-CYBMUJFWSA-N 1 1 377.229 3.481 10 0 GGAEMO CCC[N@H+]1CCC[C@@H]1C(=O)NCc1cnn(-c2ccc(Br)cc2)c1 ZINC000470346629 566866114 /nfs/dbraw/zinc/86/61/14/566866114.db2.gz RKWDWXGAPDYISS-QGZVFWFLSA-N 1 1 391.313 3.125 10 0 GGAEMO CCC[N@H+]1CCC[C@H]1C(=O)NCc1cnn(-c2ccc(Br)cc2)c1 ZINC000470346628 566866536 /nfs/dbraw/zinc/86/65/36/566866536.db2.gz RKWDWXGAPDYISS-KRWDZBQOSA-N 1 1 391.313 3.125 10 0 GGAEMO O=C(CC[N@@H+]1CCC[C@H](OC(F)F)C1)Nc1ccccc1Br ZINC000679677516 566866680 /nfs/dbraw/zinc/86/66/80/566866680.db2.gz AZRULIKSSWIZEI-NSHDSACASA-N 1 1 377.229 3.481 10 0 GGAEMO Cc1[nH+]cn(CCCCc2noc(-c3c[nH]c(=O)c(Br)c3)n2)c1C ZINC000656037650 566867129 /nfs/dbraw/zinc/86/71/29/566867129.db2.gz FPDXHLRQPMDTEP-UHFFFAOYSA-N 1 1 392.257 3.436 10 0 GGAEMO Cc1[nH+]cn(CCCCc2noc(-c3c(Br)cnn3C)n2)c1C ZINC000656040542 566867286 /nfs/dbraw/zinc/86/72/86/566867286.db2.gz NVXHFNHSQFDYHQ-UHFFFAOYSA-N 1 1 379.262 3.069 10 0 GGAEMO Cc1cc(OC[C@H](O)C[N@H+]2CCSC[C@H]2CCO)c(C(C)C)cc1Cl ZINC000470367201 566867970 /nfs/dbraw/zinc/86/79/70/566867970.db2.gz MIDZVVYJCROKGN-HZPDHXFCSA-N 1 1 387.973 3.311 10 0 GGAEMO Cc1cc(OC[C@H](O)C[N@H+]2CCSC[C@@H]2CCO)c(C(C)C)cc1Cl ZINC000470367202 566868020 /nfs/dbraw/zinc/86/80/20/566868020.db2.gz MIDZVVYJCROKGN-JKSUJKDBSA-N 1 1 387.973 3.311 10 0 GGAEMO CCC[N@H+]1CCC[C@@H]1C(=O)NCCCc1ccc(Br)cc1OC ZINC000543348484 566872287 /nfs/dbraw/zinc/87/22/87/566872287.db2.gz DFFKIFMSCFSOHM-MRXNPFEDSA-N 1 1 383.330 3.381 10 0 GGAEMO C[C@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1c(F)cncc1Br ZINC000632307413 566872579 /nfs/dbraw/zinc/87/25/79/566872579.db2.gz CNSOTJRPFNXRRC-GFCCVEGCSA-N 1 1 380.261 3.234 10 0 GGAEMO C[C@]12CC[N@@H+](C[C@H](O)COc3ccc(Br)cc3)C[C@H]1C2(F)F ZINC000428714826 566872807 /nfs/dbraw/zinc/87/28/07/566872807.db2.gz WLCCNCGPCDIQKQ-CFVMTHIKSA-N 1 1 376.241 3.166 10 0 GGAEMO NC(=O)[C@@H]([NH2+]C[C@@H]1CCC2(CCCC2)O1)c1ccc(Br)cc1F ZINC000656129714 566873045 /nfs/dbraw/zinc/87/30/45/566873045.db2.gz MPZRHYYSDNDDGD-WFASDCNBSA-N 1 1 385.277 3.196 10 0 GGAEMO NC(=O)[C@H]([NH2+]C[C@H]1CCC2(CCCC2)O1)c1ccc(Br)cc1F ZINC000656129712 566873259 /nfs/dbraw/zinc/87/32/59/566873259.db2.gz MPZRHYYSDNDDGD-IUODEOHRSA-N 1 1 385.277 3.196 10 0 GGAEMO COc1cc(Br)ccc1CN1CCC[N@@H+](C[C@@H]2CCCO2)CC1 ZINC000679770798 566873398 /nfs/dbraw/zinc/87/33/98/566873398.db2.gz QAGPCDQQDCZTEF-KRWDZBQOSA-N 1 1 383.330 3.144 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(Br)c(OC)c(OC)c2)[C@@H](C)C1 ZINC000582560274 566874174 /nfs/dbraw/zinc/87/41/74/566874174.db2.gz RXTBVSOBCUHUFC-WFASDCNBSA-N 1 1 399.329 3.269 10 0 GGAEMO CCC[N@H+]1CCC[C@H]1C(=O)N[C@@H]1CCN(c2cccc(Br)c2)C1 ZINC000470443524 566874250 /nfs/dbraw/zinc/87/42/50/566874250.db2.gz IHPAYFHLVVYOEQ-WBVHZDCISA-N 1 1 380.330 3.018 10 0 GGAEMO CC(=O)N1CC[NH+](Cc2ccc(NC(=O)c3cscc3Cl)cc2)CC1 ZINC000632318556 566874456 /nfs/dbraw/zinc/87/44/56/566874456.db2.gz DRUQJJXACIBFKC-UHFFFAOYSA-N 1 1 377.897 3.318 10 0 GGAEMO Cc1cc(Br)cc(C)c1NC(=O)CCC[N@H+]1CCCC[C@H]1C(N)=O ZINC000679817516 566874799 /nfs/dbraw/zinc/87/47/99/566874799.db2.gz MXWHOJSAIOGJRX-HNNXBMFYSA-N 1 1 396.329 3.124 10 0 GGAEMO O[C@H](COc1ccc(Cl)cc1Br)C[NH+]1CC2(CC2(F)F)C1 ZINC000656154794 566874985 /nfs/dbraw/zinc/87/49/85/566874985.db2.gz VAJPNQAJOPQRTE-JTQLQIEISA-N 1 1 382.632 3.183 10 0 GGAEMO Cc1cc(Br)cc(C)c1NC(=O)CCC[N@H+]1CCC[C@H](CO)C1 ZINC000679817462 566874998 /nfs/dbraw/zinc/87/49/98/566874998.db2.gz LZSIOYYAVQGAJM-HNNXBMFYSA-N 1 1 383.330 3.489 10 0 GGAEMO CC[N@@H+](CCCC(=O)Nc1c(C)cc(Br)cc1C)CC(=O)N(C)C ZINC000679817387 566875232 /nfs/dbraw/zinc/87/52/32/566875232.db2.gz PQWKAVUMARQHQQ-UHFFFAOYSA-N 1 1 398.345 3.195 10 0 GGAEMO OC[C@@]1(NCc2ncc(Br)s2)CCC[N@H+](Cc2ccccc2)C1 ZINC000679847457 566877330 /nfs/dbraw/zinc/87/73/30/566877330.db2.gz OZZVECIZECPLNH-QGZVFWFLSA-N 1 1 396.354 3.022 10 0 GGAEMO OC[C@@]1(NCc2ncc(Br)s2)CCC[N@@H+](Cc2ccccc2)C1 ZINC000679847457 566877341 /nfs/dbraw/zinc/87/73/41/566877341.db2.gz OZZVECIZECPLNH-QGZVFWFLSA-N 1 1 396.354 3.022 10 0 GGAEMO OC[C@@]1([NH2+]Cc2ncc(Br)s2)CCCN(Cc2ccccc2)C1 ZINC000679847457 566877352 /nfs/dbraw/zinc/87/73/52/566877352.db2.gz OZZVECIZECPLNH-QGZVFWFLSA-N 1 1 396.354 3.022 10 0 GGAEMO C[N@H+]1CCC[C@H](CCNC(=O)N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000582591469 566878210 /nfs/dbraw/zinc/87/82/10/566878210.db2.gz WUVYVSSQMJZNQZ-CZUORRHYSA-N 1 1 396.329 3.304 10 0 GGAEMO COc1ccc(CSC[C@H]2C[N@H+](C)CCO2)c(Br)c1OC ZINC000582605767 566879446 /nfs/dbraw/zinc/87/94/46/566879446.db2.gz RZMIXZIOBPTUSZ-GFCCVEGCSA-N 1 1 376.316 3.030 10 0 GGAEMO COc1ccc(CSC[C@H]2C[N@@H+](C)CCO2)c(Br)c1OC ZINC000582605767 566879450 /nfs/dbraw/zinc/87/94/50/566879450.db2.gz RZMIXZIOBPTUSZ-GFCCVEGCSA-N 1 1 376.316 3.030 10 0 GGAEMO C[NH+](C)CCN(Cc1nc2ccc(Br)cc2[nH]1)Cc1ccccn1 ZINC000563366811 566880170 /nfs/dbraw/zinc/88/01/70/566880170.db2.gz XNVJQEXHWOTZOA-UHFFFAOYSA-N 1 1 388.313 3.284 10 0 GGAEMO CN(C(=O)c1[nH]nc(-c2ccccc2)c1Br)[C@H]1CC[N@H+](C2CC2)C1 ZINC000518431460 566882096 /nfs/dbraw/zinc/88/20/96/566882096.db2.gz BUXILNVLAIKBIK-AWEZNQCLSA-N 1 1 389.297 3.148 10 0 GGAEMO C[C@@H](c1ccccc1)[C@@H]([NH2+]Cc1nc2cc(Br)ccc2[nH]1)C(N)=O ZINC000428838939 566882091 /nfs/dbraw/zinc/88/20/91/566882091.db2.gz ZFDUTRJKBYEIRF-APPDUMDISA-N 1 1 387.281 3.073 10 0 GGAEMO CS(=O)(=O)CC[C@@H]1CCCC[N@H+]1CCCc1nc(-c2cccs2)no1 ZINC000428837245 566883242 /nfs/dbraw/zinc/88/32/42/566883242.db2.gz GXBMUAKABZPUJU-AWEZNQCLSA-N 1 1 383.539 3.020 10 0 GGAEMO Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3ccc(S(N)(=O)=O)cc3)cs2)o1 ZINC000679934339 566883212 /nfs/dbraw/zinc/88/32/12/566883212.db2.gz UHCAAJZCOVFOQT-LBPRGKRZSA-N 1 1 377.491 3.210 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNS(=O)(=O)c1ccc(Br)cc1Cl ZINC000518456487 566884005 /nfs/dbraw/zinc/88/40/05/566884005.db2.gz ZMGPFFOTWFVLPK-LLVKDONJSA-N 1 1 395.750 3.255 10 0 GGAEMO COC(=O)C[C@@](C)([NH2+]Cc1snnc1C)c1ccc(Br)cc1 ZINC000582670230 566884670 /nfs/dbraw/zinc/88/46/70/566884670.db2.gz RSUFLFVUFHZNQO-OAHLLOKOSA-N 1 1 384.299 3.177 10 0 GGAEMO C[C@H](c1ccccc1)[C@@H]([NH2+]Cc1nc2cc(Br)ccc2[nH]1)C(N)=O ZINC000428838953 566884413 /nfs/dbraw/zinc/88/44/13/566884413.db2.gz ZFDUTRJKBYEIRF-PIGZYNQJSA-N 1 1 387.281 3.073 10 0 GGAEMO COc1ccc(Br)cc1C[NH2+]Cc1cnnn1Cc1ccccc1 ZINC000490896585 566884889 /nfs/dbraw/zinc/88/48/89/566884889.db2.gz AYRWPBDRBAGSPD-UHFFFAOYSA-N 1 1 387.281 3.387 10 0 GGAEMO CN(Cc1ccccc1Br)C(=O)C[N@H+]1CC[C@@H](C(C)(C)C)[C@@H](O)C1 ZINC000543483132 566885948 /nfs/dbraw/zinc/88/59/48/566885948.db2.gz IGOADJNFPZBSDI-WBVHZDCISA-N 1 1 397.357 3.136 10 0 GGAEMO NC(=O)C[C@@H]1CCCC[N@H+]1CCOc1ccc(Cl)cc1Br ZINC000518471734 566886804 /nfs/dbraw/zinc/88/68/04/566886804.db2.gz 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Ic1cccc2ncnc(N[C@H]3CC[N@H+]4CCC[C@@H]4C3)c12 ZINC000613042862 567013068 /nfs/dbraw/zinc/01/30/68/567013068.db2.gz UWIHNDJSUJWYOS-NWDGAFQWSA-N 1 1 394.260 3.273 10 0 GGAEMO COCc1nc(C[NH2+]C[C@H](O)COc2c(Cl)cccc2Cl)cs1 ZINC000564870036 567015782 /nfs/dbraw/zinc/01/57/82/567015782.db2.gz PZLJUUKLLYJKDJ-NSHDSACASA-N 1 1 377.293 3.126 10 0 GGAEMO Cc1ccsc1[C@H](CO)[NH2+]Cc1cc2c(cc1Br)OCCO2 ZINC000494681928 567016461 /nfs/dbraw/zinc/01/64/61/567016461.db2.gz NDPZCXRWUBUTMR-ZDUSSCGKSA-N 1 1 384.295 3.413 10 0 GGAEMO C[C@@H]1C[N@@H+](C)[C@H](C)CN1C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000613190968 567019906 /nfs/dbraw/zinc/01/99/06/567019906.db2.gz KNERVKXKMKVREW-ZIAGYGMSSA-N 1 1 380.330 3.214 10 0 GGAEMO C[C@@H]1[C@H](C)[N@H+](C)CCN1C(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000613225042 567021513 /nfs/dbraw/zinc/02/15/13/567021513.db2.gz FHAWCTHIYTUOFR-NKWVEPMBSA-N 1 1 383.183 3.170 10 0 GGAEMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000613225042 567021515 /nfs/dbraw/zinc/02/15/15/567021515.db2.gz FHAWCTHIYTUOFR-NKWVEPMBSA-N 1 1 383.183 3.170 10 0 GGAEMO CN(C(=O)c1cn(-c2ccc(Cl)c(Cl)c2)cn1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000430582469 567022404 /nfs/dbraw/zinc/02/24/04/567022404.db2.gz KQOPLFXKGAXPQZ-CQSZACIVSA-N 1 1 379.291 3.488 10 0 GGAEMO Cc1cc(Br)cc2c(C(=O)N3CC[N@H+](CCO)C(C)(C)C3)coc21 ZINC000682011919 567023404 /nfs/dbraw/zinc/02/34/04/567023404.db2.gz QGDOZNLEGQWIPV-UHFFFAOYSA-N 1 1 395.297 3.032 10 0 GGAEMO Cc1cc(Br)cc2c(C(=O)N3CC[N@@H+](CCO)C(C)(C)C3)coc21 ZINC000682011919 567023409 /nfs/dbraw/zinc/02/34/09/567023409.db2.gz QGDOZNLEGQWIPV-UHFFFAOYSA-N 1 1 395.297 3.032 10 0 GGAEMO COc1ccc(Br)c(CC(=O)NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)c1 ZINC000494817894 567025290 /nfs/dbraw/zinc/02/52/90/567025290.db2.gz HSGPPGNABHTSHO-OKILXGFUSA-N 1 1 383.330 3.379 10 0 GGAEMO Cc1cccc(C[N@H+]2CC[C@@H](NC(=O)c3nscc3Br)C2)c1 ZINC000634274432 567028187 /nfs/dbraw/zinc/02/81/87/567028187.db2.gz IIVNKVQESBNUOQ-CYBMUJFWSA-N 1 1 380.311 3.218 10 0 GGAEMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)[C@@H]2CCc3cc(Br)ccc32)C1 ZINC000564998479 567029963 /nfs/dbraw/zinc/02/99/63/567029963.db2.gz NOOYHUYRCCJGJQ-ZTFGCOKTSA-N 1 1 377.326 3.422 10 0 GGAEMO C[C@@H]1C[C@@H](Nc2cc(Br)cnc2C(N)=O)C[N@H+]1Cc1ccccc1 ZINC000472500575 567031792 /nfs/dbraw/zinc/03/17/92/567031792.db2.gz NIZMJKHFHWNDCG-IUODEOHRSA-N 1 1 389.297 3.018 10 0 GGAEMO C[C@H]1C[N@@H+](CCCNC(=O)[C@@H]2CCc3cc(Br)ccc32)CCCO1 ZINC000565022551 567031882 /nfs/dbraw/zinc/03/18/82/567031882.db2.gz GHFRYJIINJEKAE-KBXCAEBGSA-N 1 1 395.341 3.096 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)Nc1cc(C)c(Br)c(C)c1 ZINC000494878216 567031974 /nfs/dbraw/zinc/03/19/74/567031974.db2.gz MYQAFEFQDRQMKA-HNNXBMFYSA-N 1 1 384.318 3.298 10 0 GGAEMO Cc1nccc(NC(=O)N2CC[N@@H+](C)C[C@H]2c2ccccc2)c1Br ZINC000682108157 567032884 /nfs/dbraw/zinc/03/28/84/567032884.db2.gz UJYXCYMVSULACV-INIZCTEOSA-N 1 1 389.297 3.095 10 0 GGAEMO Cc1nccc(NC(=O)N2CC[N@H+](C)C[C@H]2c2ccccc2)c1Br ZINC000682108157 567032891 /nfs/dbraw/zinc/03/28/91/567032891.db2.gz UJYXCYMVSULACV-INIZCTEOSA-N 1 1 389.297 3.095 10 0 GGAEMO Cc1nccc(NC(=O)N2CC[N@@H+](C)C[C@@H]2c2ccccc2)c1Br ZINC000682108158 567033050 /nfs/dbraw/zinc/03/30/50/567033050.db2.gz UJYXCYMVSULACV-MRXNPFEDSA-N 1 1 389.297 3.095 10 0 GGAEMO Cc1nccc(NC(=O)N2CC[N@H+](C)C[C@@H]2c2ccccc2)c1Br ZINC000682108158 567033057 /nfs/dbraw/zinc/03/30/57/567033057.db2.gz UJYXCYMVSULACV-MRXNPFEDSA-N 1 1 389.297 3.095 10 0 GGAEMO CN(C(=O)N[C@@H]1C[C@H]1c1ccc(Br)c(F)c1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000472527339 567034204 /nfs/dbraw/zinc/03/42/04/567034204.db2.gz HLHBYCOVDARLJK-JKIFEVAISA-N 1 1 396.304 3.322 10 0 GGAEMO O[C@@H](COc1ccc(Cl)c(Cl)c1)C[N@H+]1CCC[C@H](c2ccncn2)C1 ZINC000613380939 567034344 /nfs/dbraw/zinc/03/43/44/567034344.db2.gz RCAVZCNJBPMQFQ-UONOGXRCSA-N 1 1 382.291 3.403 10 0 GGAEMO COc1ccc(CCC(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)c(Br)c1 ZINC000613377076 567034667 /nfs/dbraw/zinc/03/46/67/567034667.db2.gz YYVQIAGFMHTNIS-ZDUSSCGKSA-N 1 1 381.314 3.157 10 0 GGAEMO COc1ccc(CCC(=O)N[C@H](C)C2=CC[N@@H+](C)CC2)c(Br)c1 ZINC000613377075 567034919 /nfs/dbraw/zinc/03/49/19/567034919.db2.gz YYVQIAGFMHTNIS-CYBMUJFWSA-N 1 1 381.314 3.157 10 0 GGAEMO C[N@H+]1CCC[C@H](NC(=O)N2CCC(c3ccccc3Br)CC2)C1 ZINC000682202102 567035931 /nfs/dbraw/zinc/03/59/31/567035931.db2.gz DLXNWWPRZQTNSJ-HNNXBMFYSA-N 1 1 380.330 3.432 10 0 GGAEMO O[C@@H](COc1cc(F)cc(Br)c1)C[NH+]1CC2(C1)CC(F)(F)C2 ZINC000682219056 567037468 /nfs/dbraw/zinc/03/74/68/567037468.db2.gz NTEUDNCJCRAWBG-GFCCVEGCSA-N 1 1 380.204 3.059 10 0 GGAEMO C[N@H+](Cc1ccccc1)C[C@@H](N)c1nc(-c2ccc(Br)o2)no1 ZINC000634555093 567038146 /nfs/dbraw/zinc/03/81/46/567038146.db2.gz ZZJJROVSNQVGQQ-GFCCVEGCSA-N 1 1 377.242 3.224 10 0 GGAEMO COC(=O)c1cccc(C[NH2+][C@H](C)c2ccc(Br)cc2OC)n1 ZINC000584390360 567038615 /nfs/dbraw/zinc/03/86/15/567038615.db2.gz LQMGHTRPCZFBND-LLVKDONJSA-N 1 1 379.254 3.490 10 0 GGAEMO C[C@@H](Oc1ccc(F)cc1Br)C(=O)N(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000521081972 567040032 /nfs/dbraw/zinc/04/00/32/567040032.db2.gz FTSLAZZPQGIEHS-RISCZKNCSA-N 1 1 385.277 3.051 10 0 GGAEMO CCOc1c(Br)cc(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)cc1OC ZINC000521082194 567040094 /nfs/dbraw/zinc/04/00/94/567040094.db2.gz PVWUJVKWNFLIHF-CQSZACIVSA-N 1 1 397.313 3.165 10 0 GGAEMO NC(=O)[C@@H]([NH2+]CC1([C@H]2CCCCO2)CCC1)c1ccc(Br)cc1F ZINC000634579884 567040320 /nfs/dbraw/zinc/04/03/20/567040320.db2.gz RQPQAQAHFWLZDV-CVEARBPZSA-N 1 1 399.304 3.444 10 0 GGAEMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](C[C@H](O)COc2cc(Cl)ccc2Cl)C1 ZINC000495056774 567042383 /nfs/dbraw/zinc/04/23/83/567042383.db2.gz DRCYRKRMRQIQMD-OCCSQVGLSA-N 1 1 390.307 3.397 10 0 GGAEMO Cn1nc2c(c1C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1)CCCC2 ZINC000682428117 567042354 /nfs/dbraw/zinc/04/23/54/567042354.db2.gz PYWAGPXIEUKFKT-UHFFFAOYSA-N 1 1 391.313 3.375 10 0 GGAEMO Cc1nn2cccnc2c1C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000682428278 567042525 /nfs/dbraw/zinc/04/25/25/567042525.db2.gz VZRFJWFBFRZTAP-UHFFFAOYSA-N 1 1 388.269 3.114 10 0 GGAEMO C[C@@H](C(=O)Nc1cccc(Br)c1)[N@@H+]1CC[C@@H](C(=O)OC(C)(C)C)C1 ZINC000495075706 567043351 /nfs/dbraw/zinc/04/33/51/567043351.db2.gz UKIJLTJSIJDDFT-QWHCGFSZSA-N 1 1 397.313 3.440 10 0 GGAEMO C[C@@H](C(=O)Nc1cccc(Br)c1)[N@H+]1CC[C@@H](C(=O)OC(C)(C)C)C1 ZINC000495075706 567043356 /nfs/dbraw/zinc/04/33/56/567043356.db2.gz UKIJLTJSIJDDFT-QWHCGFSZSA-N 1 1 397.313 3.440 10 0 GGAEMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000495060641 567043369 /nfs/dbraw/zinc/04/33/69/567043369.db2.gz AJFNXPSYEKLSSI-ZDUSSCGKSA-N 1 1 397.313 3.441 10 0 GGAEMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000495060640 567043642 /nfs/dbraw/zinc/04/36/42/567043642.db2.gz AJFNXPSYEKLSSI-CYBMUJFWSA-N 1 1 397.313 3.441 10 0 GGAEMO C[C@H]1CC[N@@H+](CC(=O)N(Cc2cccc(Br)c2)C2CCOCC2)C1 ZINC000565191418 567047132 /nfs/dbraw/zinc/04/71/32/567047132.db2.gz JXQBAPWUMDPCAT-HNNXBMFYSA-N 1 1 395.341 3.299 10 0 GGAEMO CN(Cc1c(Br)cnn1C)[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC000495137328 567048005 /nfs/dbraw/zinc/04/80/05/567048005.db2.gz GNOHXHXBVAWXIP-INIZCTEOSA-N 1 1 377.330 3.279 10 0 GGAEMO CC[N@H+](CC(=O)N1CCO[C@@H]2CCCC[C@H]21)Cc1cccc(Br)c1 ZINC000521220958 567048179 /nfs/dbraw/zinc/04/81/79/567048179.db2.gz YWOJMOVUPWXWES-QZTJIDSGSA-N 1 1 395.341 3.441 10 0 GGAEMO CC[N@@H+](CC(=O)N1CCO[C@@H]2CCCC[C@H]21)Cc1cccc(Br)c1 ZINC000521220958 567048182 /nfs/dbraw/zinc/04/81/82/567048182.db2.gz YWOJMOVUPWXWES-QZTJIDSGSA-N 1 1 395.341 3.441 10 0 GGAEMO CC[N@H+](CC(=O)N1CCO[C@H]2CCCC[C@H]21)Cc1cccc(Br)c1 ZINC000521220957 567048961 /nfs/dbraw/zinc/04/89/61/567048961.db2.gz YWOJMOVUPWXWES-MSOLQXFVSA-N 1 1 395.341 3.441 10 0 GGAEMO CC[N@@H+](CC(=O)N1CCO[C@H]2CCCC[C@H]21)Cc1cccc(Br)c1 ZINC000521220957 567048964 /nfs/dbraw/zinc/04/89/64/567048964.db2.gz YWOJMOVUPWXWES-MSOLQXFVSA-N 1 1 395.341 3.441 10 0 GGAEMO CC[N@H+](CC(=O)N1CCO[C@H]2CCCC[C@@H]21)Cc1cccc(Br)c1 ZINC000521220959 567048983 /nfs/dbraw/zinc/04/89/83/567048983.db2.gz YWOJMOVUPWXWES-ROUUACIJSA-N 1 1 395.341 3.441 10 0 GGAEMO CC[N@@H+](CC(=O)N1CCO[C@H]2CCCC[C@@H]21)Cc1cccc(Br)c1 ZINC000521220959 567048989 /nfs/dbraw/zinc/04/89/89/567048989.db2.gz YWOJMOVUPWXWES-ROUUACIJSA-N 1 1 395.341 3.441 10 0 GGAEMO O=C(Nc1ccccc1)C1([NH2+]Cc2cnc3ccc(Br)cn23)CC1 ZINC000495154228 567049596 /nfs/dbraw/zinc/04/95/96/567049596.db2.gz GUBJSXLNUHCLEJ-UHFFFAOYSA-N 1 1 385.265 3.358 10 0 GGAEMO COc1ccc(Br)cc1C[NH2+]Cc1cc(C(F)(F)F)nn1C ZINC000657349892 567049677 /nfs/dbraw/zinc/04/96/77/567049677.db2.gz NTHYBWNQXPUDDS-UHFFFAOYSA-N 1 1 378.192 3.500 10 0 GGAEMO CCn1nccc1CC[NH+]1CCN(Cc2ccc(Br)s2)CC1 ZINC000472748489 567050110 /nfs/dbraw/zinc/05/01/10/567050110.db2.gz IXRHNYZBJXSBOH-UHFFFAOYSA-N 1 1 383.359 3.087 10 0 GGAEMO C[NH+](C)CCn1ccc(=NC(=O)c2cc(Br)cc3ccccc32)[nH]1 ZINC000521238298 567050349 /nfs/dbraw/zinc/05/03/49/567050349.db2.gz YPDVPGUHFPVBDB-UHFFFAOYSA-N 1 1 387.281 3.035 10 0 GGAEMO CC[C@H](c1ccc(Br)cc1)[N@H+]1CCC[C@H](C(=O)N2CCOCC2)C1 ZINC000472775442 567050813 /nfs/dbraw/zinc/05/08/13/567050813.db2.gz UUAXJJKZNYPUJG-FUHWJXTLSA-N 1 1 395.341 3.471 10 0 GGAEMO FC(F)(F)c1cnc(OCC[NH2+]Cc2cn(C3CCC3)nn2)c(Cl)c1 ZINC000657375433 567051043 /nfs/dbraw/zinc/05/10/43/567051043.db2.gz YXLJUSLFQQRDBT-UHFFFAOYSA-N 1 1 375.782 3.239 10 0 GGAEMO Brc1ccccc1N1CC[C@H]([NH2+]Cc2ccnn2-c2ccncc2)C1 ZINC000657357132 567051100 /nfs/dbraw/zinc/05/11/00/567051100.db2.gz RBTSHWAUKQPLCD-HNNXBMFYSA-N 1 1 398.308 3.398 10 0 GGAEMO CC[N@@H+]1CC[C@H](CN[C@@H](C)c2ccc(F)c(I)c2)C1 ZINC000453057905 567051172 /nfs/dbraw/zinc/05/11/72/567051172.db2.gz FZPIWMSRVFLZTL-NWDGAFQWSA-N 1 1 376.257 3.423 10 0 GGAEMO CC[N@H+]1CC[C@H](CN[C@@H](C)c2ccc(F)c(I)c2)C1 ZINC000453057905 567051178 /nfs/dbraw/zinc/05/11/78/567051178.db2.gz FZPIWMSRVFLZTL-NWDGAFQWSA-N 1 1 376.257 3.423 10 0 GGAEMO CC[C@H](c1ccc(Br)cc1)[N@H+]1CCC[C@@H](C(=O)N2CCOCC2)C1 ZINC000472775443 567051507 /nfs/dbraw/zinc/05/15/07/567051507.db2.gz UUAXJJKZNYPUJG-SJLPKXTDSA-N 1 1 395.341 3.471 10 0 GGAEMO C[NH+]1CCC(CNCc2c(F)cncc2Br)(N2CCCCC2)CC1 ZINC000657378411 567051559 /nfs/dbraw/zinc/05/15/59/567051559.db2.gz VJAJERBHECVTCV-UHFFFAOYSA-N 1 1 399.352 3.023 10 0 GGAEMO COCc1ccccc1CS(=O)(=O)Nc1ccc(Cl)c(C[NH+](C)C)c1 ZINC000565269139 567051777 /nfs/dbraw/zinc/05/17/77/567051777.db2.gz IHMGIAIYKMYNSN-UHFFFAOYSA-N 1 1 382.913 3.490 10 0 GGAEMO Cn1nc(C(F)(F)F)cc1C[NH2+][C@@H](CO)c1cccc(Br)c1 ZINC000657398242 567054637 /nfs/dbraw/zinc/05/46/37/567054637.db2.gz AHZZEFNVRPDMMN-LBPRGKRZSA-N 1 1 378.192 3.025 10 0 GGAEMO O=C([C@H]1CCc2cc(Br)ccc21)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000565304202 567055267 /nfs/dbraw/zinc/05/52/67/567055267.db2.gz POZQHMMGMHKBOX-ROUUACIJSA-N 1 1 386.293 3.047 10 0 GGAEMO O=S(=O)(CC[NH2+][C@@H](CCO)c1ccc(Cl)c(F)c1)c1ccc(F)cc1 ZINC000634724615 567055265 /nfs/dbraw/zinc/05/52/65/567055265.db2.gz UAUBEQKRAGXJKP-KRWDZBQOSA-N 1 1 389.851 3.105 10 0 GGAEMO O=C(CC[N@H+]1CCO[C@@H](C(F)F)CC1)Nc1ccc(Br)cc1F ZINC000634751306 567055633 /nfs/dbraw/zinc/05/56/33/567055633.db2.gz OMEAUIBLXAWWBS-CYBMUJFWSA-N 1 1 395.219 3.273 10 0 GGAEMO 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/nfs/dbraw/zinc/05/85/85/567058585.db2.gz KMHAOXZZYZTHNB-CYBMUJFWSA-N 1 1 377.229 3.134 10 0 GGAEMO O=C(NC[C@@H]1CCC[N@@H+](Cc2cccs2)C1)N[C@@H](CO)c1ccsc1 ZINC000472962485 567058746 /nfs/dbraw/zinc/05/87/46/567058746.db2.gz WHYMJVXYZWHUIT-YOEHRIQHSA-N 1 1 379.551 3.054 10 0 GGAEMO Cc1cc(Br)ccc1NC(=O)C[N@@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000495445191 567061430 /nfs/dbraw/zinc/06/14/30/567061430.db2.gz ROFRZBBHVIJILA-GOEBONIOSA-N 1 1 383.330 3.425 10 0 GGAEMO Cc1cc(Br)ccc1NC(=O)C[N@H+]1CC[C@H](C(C)(C)C)[C@H](O)C1 ZINC000495445191 567061437 /nfs/dbraw/zinc/06/14/37/567061437.db2.gz ROFRZBBHVIJILA-GOEBONIOSA-N 1 1 383.330 3.425 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(C)n(-c2ccc(Br)cc2)n1 ZINC000431166489 567061574 /nfs/dbraw/zinc/06/15/74/567061574.db2.gz KQJFFXGEVLCWNL-MRXNPFEDSA-N 1 1 391.313 3.157 10 0 GGAEMO COc1cc(C[NH2+]Cc2c(C(F)(F)F)cnn2C)c(Br)cc1O ZINC000657500680 567062526 /nfs/dbraw/zinc/06/25/26/567062526.db2.gz QMXRBILBFGGOMS-UHFFFAOYSA-N 1 1 394.191 3.205 10 0 GGAEMO CCS(=O)(=O)c1cc(Cl)cc(C[NH2+]Cc2c(C3CCC3)cnn2C)c1 ZINC000657490083 567062604 /nfs/dbraw/zinc/06/26/04/567062604.db2.gz DLDLXKJXDKPVIC-UHFFFAOYSA-N 1 1 381.929 3.424 10 0 GGAEMO C[C@@H]([NH2+]Cc1ccc(S(C)(=O)=O)s1)c1cc(-c2ccccc2)nn1C ZINC000453218363 567064993 /nfs/dbraw/zinc/06/49/93/567064993.db2.gz KTNFEXKUASAFAO-CYBMUJFWSA-N 1 1 375.519 3.403 10 0 GGAEMO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@H](CO)c2ccsc2)c(Br)c1 ZINC000473169400 567065988 /nfs/dbraw/zinc/06/59/88/567065988.db2.gz JKFIAENYQVHNDP-XHDPSFHLSA-N 1 1 383.311 3.469 10 0 GGAEMO Cc1cc(NC(=O)[C@H](C)[NH2+][C@H](CO)c2ccsc2)ccc1Br ZINC000473165876 567066028 /nfs/dbraw/zinc/06/60/28/567066028.db2.gz GSOQYVDQZSFMDP-XHDPSFHLSA-N 1 1 383.311 3.469 10 0 GGAEMO Cc1nc2ccccn2c(=O)c1CC[N@H+](C)Cc1ccccc1Br ZINC000565413158 567066016 /nfs/dbraw/zinc/06/60/16/567066016.db2.gz SDZVXACQGMDCHC-UHFFFAOYSA-N 1 1 386.293 3.440 10 0 GGAEMO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](CO)c2ccsc2)c(Br)c1 ZINC000473169397 567066070 /nfs/dbraw/zinc/06/60/70/567066070.db2.gz JKFIAENYQVHNDP-ABAIWWIYSA-N 1 1 383.311 3.469 10 0 GGAEMO C[C@@H]([NH2+][C@@H](CO)c1ccsc1)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000473178717 567066516 /nfs/dbraw/zinc/06/65/16/567066516.db2.gz ZNSJMHDUSFTCHK-WBMJQRKESA-N 1 1 397.338 3.181 10 0 GGAEMO C[C@H](NC(=O)C[NH2+][C@@H](CO)c1ccsc1)c1ccc(Br)cc1 ZINC000473175471 567067360 /nfs/dbraw/zinc/06/73/60/567067360.db2.gz HQBIRWSNAFCOTQ-NHYWBVRUSA-N 1 1 383.311 3.011 10 0 GGAEMO C[C@@H]([NH2+][C@H](CO)c1ccsc1)C(=O)N(C)Cc1ccc(Br)cc1 ZINC000473178716 567067449 /nfs/dbraw/zinc/06/74/49/567067449.db2.gz ZNSJMHDUSFTCHK-MLGOLLRUSA-N 1 1 397.338 3.181 10 0 GGAEMO C[N@H+]1CCC[C@@H](NC(=O)N(Cc2cccc(Br)c2)CC2CC2)C1 ZINC000682702227 567067705 /nfs/dbraw/zinc/06/77/05/567067705.db2.gz FUACZGHEAMFRGO-QGZVFWFLSA-N 1 1 380.330 3.465 10 0 GGAEMO C[C@@H](NC(=O)C[NH2+][C@H](CO)c1ccsc1)c1ccc(Br)cc1 ZINC000473175470 567067928 /nfs/dbraw/zinc/06/79/28/567067928.db2.gz HQBIRWSNAFCOTQ-IAQYHMDHSA-N 1 1 383.311 3.011 10 0 GGAEMO C[NH+]1CCN(c2ncc(Br)cc2NC(=O)N2CCCC2(C)C)CC1 ZINC000584763941 567068263 /nfs/dbraw/zinc/06/82/63/567068263.db2.gz VSWBTDLCNVHTKF-UHFFFAOYSA-N 1 1 396.333 3.002 10 0 GGAEMO OCCC[N@@H+]1CCC[C@H]1CN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000453266978 567068695 /nfs/dbraw/zinc/06/86/95/567068695.db2.gz OVHCDUNOUIZAEM-DOTOQJQBSA-N 1 1 383.330 3.099 10 0 GGAEMO OCCC[N@H+]1CCC[C@H]1CN[C@@H]1CCCOc2ccc(Br)cc21 ZINC000453266978 567068703 /nfs/dbraw/zinc/06/87/03/567068703.db2.gz OVHCDUNOUIZAEM-DOTOQJQBSA-N 1 1 383.330 3.099 10 0 GGAEMO Cc1nc(C[NH2+][C@@H](C)c2ccc3c(c2)OCC(=O)N3)sc1Br ZINC000453259470 567069037 /nfs/dbraw/zinc/06/90/37/567069037.db2.gz CDVBJMUZQSKTDX-QMMMGPOBSA-N 1 1 382.283 3.396 10 0 GGAEMO FC(F)(F)c1ncc(C[NH2+]Cc2cc3c(c(Br)c2)OCO3)cn1 ZINC000657550572 567069531 /nfs/dbraw/zinc/06/95/31/567069531.db2.gz OZOUDUQHAKMXMA-UHFFFAOYSA-N 1 1 390.159 3.276 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CCC(=O)N[C@@H]1CCN(c2ccc(Br)cc2)C1 ZINC000496111609 567069844 /nfs/dbraw/zinc/06/98/44/567069844.db2.gz NOCMAUFERPYBKX-SJORKVTESA-N 1 1 394.357 3.409 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CCC(=O)N[C@H]1CCN(c2ccc(Br)cc2)C1 ZINC000496111606 567070137 /nfs/dbraw/zinc/07/01/37/567070137.db2.gz NOCMAUFERPYBKX-IRXDYDNUSA-N 1 1 394.357 3.409 10 0 GGAEMO C[N@H+]1CCCC[C@@H]1CCC(=O)N[C@@H]1CCN(c2ccc(Br)cc2)C1 ZINC000496111604 567070593 /nfs/dbraw/zinc/07/05/93/567070593.db2.gz NOCMAUFERPYBKX-IAGOWNOFSA-N 1 1 394.357 3.409 10 0 GGAEMO O=S1(=O)CC[C@H](CC[N@H+](Cc2cccc(Br)c2)CC2CC2)C1 ZINC000682776889 567071414 /nfs/dbraw/zinc/07/14/14/567071414.db2.gz ADVDRMVONNDSEJ-HNNXBMFYSA-N 1 1 386.355 3.486 10 0 GGAEMO COc1ccc(Br)c(C[NH2+][C@@H]2Cc3ccccc3N(C)C2=O)c1 ZINC000657574762 567073159 /nfs/dbraw/zinc/07/31/59/567073159.db2.gz MWTXDLYSTIDBGG-MRXNPFEDSA-N 1 1 375.266 3.135 10 0 GGAEMO O[C@H]1CC[N@@H+](Cc2ccc(CNCc3cccc(F)c3Br)cc2)C1 ZINC000657595722 567073778 /nfs/dbraw/zinc/07/37/78/567073778.db2.gz JOBWLMCOELPYAQ-KRWDZBQOSA-N 1 1 393.300 3.445 10 0 GGAEMO Cc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H](C)C2)nn1-c1ccc(Br)cc1 ZINC000431324244 567074728 /nfs/dbraw/zinc/07/47/28/567074728.db2.gz VHHDPVMYIOXUCO-SWLSCSKDSA-N 1 1 391.313 3.156 10 0 GGAEMO O[C@H]1CC[N@H+](Cc2ccc(CNCc3ccc(Br)cc3F)cc2)C1 ZINC000657593994 567074877 /nfs/dbraw/zinc/07/48/77/567074877.db2.gz GAUSMLYKXUNWBW-SFHVURJKSA-N 1 1 393.300 3.445 10 0 GGAEMO O[C@H]1CC[N@@H+](Cc2ccc(CNCc3ccc(Br)cc3F)cc2)C1 ZINC000657593994 567074881 /nfs/dbraw/zinc/07/48/81/567074881.db2.gz GAUSMLYKXUNWBW-SFHVURJKSA-N 1 1 393.300 3.445 10 0 GGAEMO O[C@H]1CC[N@H+](Cc2ccc(CNCc3sccc3Br)cc2)C1 ZINC000657594848 567075118 /nfs/dbraw/zinc/07/51/18/567075118.db2.gz DICOFROCIUOMKM-HNNXBMFYSA-N 1 1 381.339 3.367 10 0 GGAEMO O[C@H]1CC[N@@H+](Cc2ccc(CNCc3sccc3Br)cc2)C1 ZINC000657594848 567075123 /nfs/dbraw/zinc/07/51/23/567075123.db2.gz DICOFROCIUOMKM-HNNXBMFYSA-N 1 1 381.339 3.367 10 0 GGAEMO O[C@H]1CC[N@@H+](Cc2ccc(CNCc3ccc(F)cc3Br)cc2)C1 ZINC000657596988 567075257 /nfs/dbraw/zinc/07/52/57/567075257.db2.gz PZAAUVJUKRJRQK-SFHVURJKSA-N 1 1 393.300 3.445 10 0 GGAEMO Oc1ccc(Br)c(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000657596431 567075278 /nfs/dbraw/zinc/07/52/78/567075278.db2.gz NFMSHOIAWZKZCL-GOSISDBHSA-N 1 1 391.309 3.011 10 0 GGAEMO Cc1cc(C(=O)N[C@@H]2CC[N@@H+](C)[C@H](C)C2)nn1-c1ccc(Br)cc1 ZINC000431324243 567075334 /nfs/dbraw/zinc/07/53/34/567075334.db2.gz VHHDPVMYIOXUCO-IUODEOHRSA-N 1 1 391.313 3.156 10 0 GGAEMO Oc1cccc(CNCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)c1Br ZINC000657597301 567075298 /nfs/dbraw/zinc/07/52/98/567075298.db2.gz SPAYTBYUXZBRAE-QGZVFWFLSA-N 1 1 391.309 3.011 10 0 GGAEMO Cc1ccc(C(=O)NC[C@@H](C(C)C)[NH+]2CCOCC2)c(C)c1Br ZINC000682856233 567076142 /nfs/dbraw/zinc/07/61/42/567076142.db2.gz DYQNMERQSBQHIG-INIZCTEOSA-N 1 1 383.330 3.153 10 0 GGAEMO Cc1nc(C[NH+]2CCC(C(=O)N3CC[C@@H](C(F)(F)F)[C@H]3C)CC2)cs1 ZINC000473389588 567076210 /nfs/dbraw/zinc/07/62/10/567076210.db2.gz PFUADAWQGRIMQE-IAQYHMDHSA-N 1 1 375.460 3.463 10 0 GGAEMO FC1(F)C[C@H]1OCC[NH2+]Cc1c(Br)cncc1Br ZINC000657619470 567076500 /nfs/dbraw/zinc/07/65/00/567076500.db2.gz QAFKVCIRIOIMEA-SNVBAGLBSA-N 1 1 386.034 3.120 10 0 GGAEMO C[C@H]1CC[C@@H]([NH2+]Cc2cc(OC(F)F)ccc2Br)CS1(=O)=O ZINC000657636252 567078268 /nfs/dbraw/zinc/07/82/68/567078268.db2.gz BECRIBJISDZADD-GXSJLCMTSA-N 1 1 398.269 3.106 10 0 GGAEMO C[C@@H]1CC[C@@H]([NH2+]Cc2cc(Br)ccc2OC(F)F)CS1(=O)=O ZINC000657635299 567078877 /nfs/dbraw/zinc/07/88/77/567078877.db2.gz OYDCSPYAQVGORJ-BXKDBHETSA-N 1 1 398.269 3.106 10 0 GGAEMO CN1CC[C@H]([NH2+]C[C@H](CO)Cc2cc(Br)ccc2F)[C@@H]2CCC[C@H]21 ZINC000453367421 567080519 /nfs/dbraw/zinc/08/05/19/567080519.db2.gz MMFZCPKHVCFETQ-SKSLQVBQSA-N 1 1 399.348 3.202 10 0 GGAEMO O=C(c1cc2c(Br)cccc2cn1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614089301 567082477 /nfs/dbraw/zinc/08/24/77/567082477.db2.gz INHGGPUBVMUDNA-DOTOQJQBSA-N 1 1 392.272 3.256 10 0 GGAEMO O=C(CCc1cccc(F)c1Br)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614088506 567082811 /nfs/dbraw/zinc/08/28/11/567082811.db2.gz CIFATMUFXKKKAO-CABCVRRESA-N 1 1 387.268 3.166 10 0 GGAEMO O=C(N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1)C1(Cc2ccccc2Br)CC1 ZINC000614088267 567082882 /nfs/dbraw/zinc/08/28/82/567082882.db2.gz ARLFBCRHTGCQMD-IRXDYDNUSA-N 1 1 395.316 3.417 10 0 GGAEMO Cc1ccc(C(=O)N[C@H]2CCCC[C@H]2[NH+]2CCOCC2)c(C)c1Br ZINC000682919823 567082884 /nfs/dbraw/zinc/08/28/84/567082884.db2.gz LGZQPAASRNZZEE-DLBZAZTESA-N 1 1 395.341 3.439 10 0 GGAEMO O=C(CCc1cccc(F)c1Br)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614088508 567083028 /nfs/dbraw/zinc/08/30/28/567083028.db2.gz CIFATMUFXKKKAO-HUUCEWRRSA-N 1 1 387.268 3.166 10 0 GGAEMO O=C(Cc1cc(Cl)ccc1Br)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614096211 567083815 /nfs/dbraw/zinc/08/38/15/567083815.db2.gz XMNIYRWLLJDQNX-LSDHHAIUSA-N 1 1 389.696 3.290 10 0 GGAEMO O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614096970 567083929 /nfs/dbraw/zinc/08/39/29/567083929.db2.gz DARLGIMSRJJEMY-UONOGXRCSA-N 1 1 393.659 3.500 10 0 GGAEMO O=C(c1ccc(Cl)c(Br)c1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614092877 567083992 /nfs/dbraw/zinc/08/39/92/567083992.db2.gz HFWZQSCIYNQKQP-KBPBESRZSA-N 1 1 375.669 3.361 10 0 GGAEMO O=C(c1ccc(Br)c(Cl)c1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614096478 567084081 /nfs/dbraw/zinc/08/40/81/567084081.db2.gz YUFREJQKBADEGP-UONOGXRCSA-N 1 1 375.669 3.361 10 0 GGAEMO Cn1cc(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@@H](F)C2)c(-c2ccc(Cl)s2)n1 ZINC000614092820 567084422 /nfs/dbraw/zinc/08/44/22/567084422.db2.gz MELDXWQHSBFIDR-QWHCGFSZSA-N 1 1 382.892 3.060 10 0 GGAEMO O=C(c1ccc(Cl)c(Br)c1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614092886 567084442 /nfs/dbraw/zinc/08/44/42/567084442.db2.gz HFWZQSCIYNQKQP-KGLIPLIRSA-N 1 1 375.669 3.361 10 0 GGAEMO O=C(c1cc(Cl)c(F)cc1Br)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614091652 567084503 /nfs/dbraw/zinc/08/45/03/567084503.db2.gz XAQXOBHDJMJHFO-UONOGXRCSA-N 1 1 393.659 3.500 10 0 GGAEMO O=C(c1cc(F)c(Br)c(Cl)c1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614097689 567084600 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ZINC000614104892 567086119 /nfs/dbraw/zinc/08/61/19/567086119.db2.gz TXSOIGWFUKWGIZ-HZPDHXFCSA-N 1 1 399.304 3.495 10 0 GGAEMO Cc1ccc(O[C@H](C)C(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)c(Br)c1 ZINC000614105060 567086340 /nfs/dbraw/zinc/08/63/40/567086340.db2.gz ZQEZWUFQQBAOKS-BMFZPTHFSA-N 1 1 399.304 3.170 10 0 GGAEMO C[C@H](CNC(=O)N1CC[NH+](C2CC2)CC1)Sc1ccc(Br)cc1 ZINC000521901402 567086329 /nfs/dbraw/zinc/08/63/29/567086329.db2.gz IERNJLIAEIWJKC-CYBMUJFWSA-N 1 1 398.370 3.419 10 0 GGAEMO O=C(c1cc2cc(Br)sc2[nH]1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614099734 567086366 /nfs/dbraw/zinc/08/63/66/567086366.db2.gz DLUHHVHZNHDRME-JQWIXIFHSA-N 1 1 386.290 3.250 10 0 GGAEMO O=C(CSc1cccc(C(F)(F)F)c1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614104050 567086384 /nfs/dbraw/zinc/08/63/84/567086384.db2.gz FBYYANHBIDKFTF-LSDHHAIUSA-N 1 1 376.419 3.442 10 0 GGAEMO O=C(c1cc(Cl)cc(Br)c1F)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614100242 567086423 /nfs/dbraw/zinc/08/64/23/567086423.db2.gz 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C[N@H+](Cc1ccccc1)C[C@H](O)CN1CCc2cc(Br)ccc2C1 ZINC000683028070 567092997 /nfs/dbraw/zinc/09/29/97/567092997.db2.gz PBHFQONMVRUWTN-FQEVSTJZSA-N 1 1 389.337 3.300 10 0 GGAEMO C[N@H+](Cc1ccccc1)C[C@@H](O)CN1CCc2cc(Br)ccc2C1 ZINC000683028071 567093264 /nfs/dbraw/zinc/09/32/64/567093264.db2.gz PBHFQONMVRUWTN-HXUWFJFHSA-N 1 1 389.337 3.300 10 0 GGAEMO COC(C)(C)CS(=O)(=O)NC[C@@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1 ZINC000565742717 567094004 /nfs/dbraw/zinc/09/40/04/567094004.db2.gz DEQGZVZYTPIDLA-KRWDZBQOSA-N 1 1 388.961 3.039 10 0 GGAEMO COC(C)(C)CS(=O)(=O)NC[C@@H]1CCCC[N@H+]1Cc1cccc(Cl)c1 ZINC000565742717 567094008 /nfs/dbraw/zinc/09/40/08/567094008.db2.gz DEQGZVZYTPIDLA-KRWDZBQOSA-N 1 1 388.961 3.039 10 0 GGAEMO COC(C)(C)CS(=O)(=O)NC[C@H]1CCCC[N@@H+]1Cc1cccc(Cl)c1 ZINC000565742721 567094265 /nfs/dbraw/zinc/09/42/65/567094265.db2.gz DEQGZVZYTPIDLA-QGZVFWFLSA-N 1 1 388.961 3.039 10 0 GGAEMO COC(C)(C)CS(=O)(=O)NC[C@H]1CCCC[N@H+]1Cc1cccc(Cl)c1 ZINC000565742721 567094269 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CC[N@@H+](CCNC(=O)c1ncc(Br)cc1Br)C(C)C ZINC000546093931 567105013 /nfs/dbraw/zinc/10/50/13/567105013.db2.gz MAMACRNJHCLNAC-UHFFFAOYSA-N 1 1 393.123 3.067 10 0 GGAEMO C[C@H](NC(=O)NCCC[N@@H+](C)C1CCCCC1)c1ncc(Br)cn1 ZINC000431774377 567107805 /nfs/dbraw/zinc/10/78/05/567107805.db2.gz FCLALUCTCZBSAK-ZDUSSCGKSA-N 1 1 398.349 3.254 10 0 GGAEMO O=C1CCCN1CCC[N@@H+]1CCC[C@@H]1c1ccccc1I ZINC000522245704 567108439 /nfs/dbraw/zinc/10/84/39/567108439.db2.gz XAUNNOOGBFCEBZ-MRXNPFEDSA-N 1 1 398.288 3.441 10 0 GGAEMO CN(CC[N@@H+](C)C1CCN(C)CC1)C(=O)c1c(Cl)cc(F)cc1Cl ZINC000431827374 567110762 /nfs/dbraw/zinc/11/07/62/567110762.db2.gz DXAMGLUFIRUKCF-UHFFFAOYSA-N 1 1 376.303 3.231 10 0 GGAEMO CN(CCN(C)C1CC[NH+](C)CC1)C(=O)c1c(Cl)cc(F)cc1Cl ZINC000431827374 567110765 /nfs/dbraw/zinc/11/07/65/567110765.db2.gz DXAMGLUFIRUKCF-UHFFFAOYSA-N 1 1 376.303 3.231 10 0 GGAEMO C[N@H+]1CCN(C(=O)c2cc(Br)cc(N3CCCC3)c2)CC1(C)C ZINC000614409740 567110997 /nfs/dbraw/zinc/11/09/97/567110997.db2.gz 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C[C@@H](Nc1ccc2c(c1)C[N@H+](CC(N)=O)CC2)c1cccc(Br)c1 ZINC000433094003 567221870 /nfs/dbraw/zinc/22/18/70/567221870.db2.gz SRVJXFXCNIDKNO-CYBMUJFWSA-N 1 1 388.309 3.466 10 0 GGAEMO C[N@H+]1CCC[C@@H](NC(=O)N[C@H]2C[C@H](c3ccc(F)c(Br)c3)C2)C1 ZINC000684656096 567225071 /nfs/dbraw/zinc/22/50/71/567225071.db2.gz WNTVBOSXUZICME-MGPQQGTHSA-N 1 1 384.293 3.228 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)C2=Cc3cc(Br)ccc3OC2)[C@H](C)C1 ZINC000525033641 567226437 /nfs/dbraw/zinc/22/64/37/567226437.db2.gz SXAKLIHRBYKFFY-CXAGYDPISA-N 1 1 393.325 3.414 10 0 GGAEMO COc1ccc(Br)c(CNC(=O)NCC[N@H+]2CCCC[C@H]2C)c1 ZINC000616080729 567226928 /nfs/dbraw/zinc/22/69/28/567226928.db2.gz ZPQYZPOLJXLWIZ-CYBMUJFWSA-N 1 1 384.318 3.131 10 0 GGAEMO CCC[C@@H]1CN(C(=O)Nc2nc(C(F)(F)F)cs2)CC[N@H+]1CCOC ZINC000499143503 567226997 /nfs/dbraw/zinc/22/69/97/567226997.db2.gz YDKKCGKYXSJHPK-LLVKDONJSA-N 1 1 380.436 3.127 10 0 GGAEMO Cc1cc([C@@H]2CCC[N@H+]2C[C@@H](O)COC[C@@H]2CCCO2)ccc1Br ZINC000684668079 567227528 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Cc1cc(Br)ccc1NC(=O)C[N@H+](C)CCO[C@@H]1CC1(F)F ZINC000659833077 567230828 /nfs/dbraw/zinc/23/08/28/567230828.db2.gz HBIUXFTVJFRAKG-CYBMUJFWSA-N 1 1 377.229 3.052 10 0 GGAEMO Cc1cc(Br)ccc1NC(=O)C[N@@H+](C)CCO[C@@H]1CC1(F)F ZINC000659833077 567230831 /nfs/dbraw/zinc/23/08/31/567230831.db2.gz HBIUXFTVJFRAKG-CYBMUJFWSA-N 1 1 377.229 3.052 10 0 GGAEMO CCC[N@H+](CCN1C(=O)CN(C)C1=O)[C@@H](C)c1ccccc1Br ZINC000659844356 567230981 /nfs/dbraw/zinc/23/09/81/567230981.db2.gz CROAPJVHCJODHY-ZDUSSCGKSA-N 1 1 382.302 3.116 10 0 GGAEMO CCC[N@@H+](CCN1C(=O)CN(C)C1=O)[C@@H](C)c1ccccc1Br ZINC000659844356 567230984 /nfs/dbraw/zinc/23/09/84/567230984.db2.gz CROAPJVHCJODHY-ZDUSSCGKSA-N 1 1 382.302 3.116 10 0 GGAEMO O=C(Cc1noc2ccc(Br)cc21)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000567262803 567231223 /nfs/dbraw/zinc/23/12/23/567231223.db2.gz AQWYDJMZNGDMDP-CQSZACIVSA-N 1 1 392.297 3.266 10 0 GGAEMO Cn1cc(Br)c(C[NH2+][C@@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)n1 ZINC000433212508 567233427 /nfs/dbraw/zinc/23/34/27/567233427.db2.gz JGHOOBXQVOHZMP-ZBFHGGJFSA-N 1 1 383.721 3.371 10 0 GGAEMO NC(=O)C[N@@H+]1CCc2ccc(NCc3ccc(F)cc3Br)cc2C1 ZINC000433209933 567233471 /nfs/dbraw/zinc/23/34/71/567233471.db2.gz ZECKHCOOOZMLJR-UHFFFAOYSA-N 1 1 392.272 3.044 10 0 GGAEMO NC(=O)C[N@H+]1CCc2ccc(NCc3ccc(F)cc3Br)cc2C1 ZINC000433209933 567233479 /nfs/dbraw/zinc/23/34/79/567233479.db2.gz ZECKHCOOOZMLJR-UHFFFAOYSA-N 1 1 392.272 3.044 10 0 GGAEMO COCC[N@H+](Cc1scnc1C)Cc1ccc(Cl)cc1-n1cncn1 ZINC000475231471 567234530 /nfs/dbraw/zinc/23/45/30/567234530.db2.gz HSYYUMFQBBSFQZ-UHFFFAOYSA-N 1 1 377.901 3.334 10 0 GGAEMO COCC[N@@H+](Cc1scnc1C)Cc1ccc(Cl)cc1-n1cncn1 ZINC000475231471 567234535 /nfs/dbraw/zinc/23/45/35/567234535.db2.gz HSYYUMFQBBSFQZ-UHFFFAOYSA-N 1 1 377.901 3.334 10 0 GGAEMO Cc1nc(CCNC(=O)NC[C@H]2CCC[N@H+](C)[C@H]2c2cccs2)cs1 ZINC000525256619 567238022 /nfs/dbraw/zinc/23/80/22/567238022.db2.gz DCIKPBDKFNWJBI-RHSMWYFYSA-N 1 1 378.567 3.438 10 0 GGAEMO C[C@@H]1CC[C@H](C[NH+]2CCN(C(=O)COc3ccc(Cl)cc3Cl)CC2)O1 ZINC000475318194 567240432 /nfs/dbraw/zinc/24/04/32/567240432.db2.gz PTEGJRBKCYQVTB-UKRRQHHQSA-N 1 1 387.307 3.084 10 0 GGAEMO Brc1ccc(OCC[N@H+]2CCCC[C@H]2CN2CCOCC2)cc1 ZINC000525283314 567240833 /nfs/dbraw/zinc/24/08/33/567240833.db2.gz NFJLOJGITGWFCI-KRWDZBQOSA-N 1 1 383.330 3.015 10 0 GGAEMO C[N@H+]1CCC[C@@H](NC(=O)N2CCC(c3cccc(Br)c3)CC2)C1 ZINC000684888479 567244193 /nfs/dbraw/zinc/24/41/93/567244193.db2.gz CVSNPKTYDBACJK-QGZVFWFLSA-N 1 1 380.330 3.432 10 0 GGAEMO O=C(Cc1ccc(Br)cc1O)N1CCC[N@H+](C2CCCC2)CC1 ZINC000433350530 567244513 /nfs/dbraw/zinc/24/45/13/567244513.db2.gz FOFICOAQQOWHPK-UHFFFAOYSA-N 1 1 381.314 3.174 10 0 GGAEMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3c(F)c(F)c(Br)c(F)c3F)[C@@H]2C1 ZINC000616420632 567244727 /nfs/dbraw/zinc/24/47/27/567244727.db2.gz OZXZRAWSWAGTTR-JGVFFNPUSA-N 1 1 395.194 3.172 10 0 GGAEMO CCCN(C(=O)CCc1ccc(OC)cc1Br)[C@H]1CC[N@@H+](C)C1 ZINC000616468228 567247228 /nfs/dbraw/zinc/24/72/28/567247228.db2.gz VDXSLGIKLJLMRN-HNNXBMFYSA-N 1 1 383.330 3.333 10 0 GGAEMO Cn1cc(-c2cc(C[NH2+][C@](C)(CO)c3cc(Cl)cc(Cl)c3)on2)cn1 ZINC000567455930 567247569 /nfs/dbraw/zinc/24/75/69/567247569.db2.gz UEYUMDUKZLGSQD-QGZVFWFLSA-N 1 1 381.263 3.379 10 0 GGAEMO CCC[C@H]1CN(C(=O)Cc2ccc(Br)s2)CC[N@H+]1CCOC ZINC000499441260 567249820 /nfs/dbraw/zinc/24/98/20/567249820.db2.gz IBMBVXYLEFLCKA-ZDUSSCGKSA-N 1 1 389.359 3.012 10 0 GGAEMO O=C(Nc1cccc(Cl)c1)N1CCC[N@H+](CC2(O)CCSCC2)CC1 ZINC000660048468 567252508 /nfs/dbraw/zinc/25/25/08/567252508.db2.gz OUJDHABOSPYBDN-UHFFFAOYSA-N 1 1 383.945 3.138 10 0 GGAEMO O=S(=O)(NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1cccs1 ZINC000660057747 567253701 /nfs/dbraw/zinc/25/37/01/567253701.db2.gz QRIYWWBYBCCZRF-QGZVFWFLSA-N 1 1 376.547 3.329 10 0 GGAEMO C[C@H]1C[C@H](NC(=O)CSCc2ccc(Br)cc2F)CC[N@H+]1C ZINC000525617495 567254963 /nfs/dbraw/zinc/25/49/63/567254963.db2.gz ODFNUBVHOFIQMN-SMDDNHRTSA-N 1 1 389.334 3.420 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)C(=O)CCOc2cccc(Br)c2)[C@H](C)C1 ZINC000525621966 567255064 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CC[NH+](CC)[C@@H](CNS(=O)(=O)c1ccc2ncsc2c1)c1ccco1 ZINC000475571598 567259502 /nfs/dbraw/zinc/25/95/02/567259502.db2.gz MMGDXDMSVDTEBN-HNNXBMFYSA-N 1 1 379.507 3.251 10 0 GGAEMO O=S(=O)(C[C@H]1CCCC1(F)F)N1CC[NH2+]C[C@H]1c1cccc(Cl)c1 ZINC000567588791 567259578 /nfs/dbraw/zinc/25/95/78/567259578.db2.gz JUDRWRHWUWWKIF-HIFRSBDPSA-N 1 1 378.872 3.052 10 0 GGAEMO CN(C)c1noc(C[NH+]2CCC(C)(c3cccc(Br)c3)CC2)n1 ZINC000499600042 567259978 /nfs/dbraw/zinc/25/99/78/567259978.db2.gz MVQXWAWZFBKDNE-UHFFFAOYSA-N 1 1 379.302 3.452 10 0 GGAEMO CCc1[nH+]ccn1[C@H](C)CC(=O)N[C@](C)(CO)c1ccc(Br)cc1 ZINC000616833557 567261874 /nfs/dbraw/zinc/26/18/74/567261874.db2.gz CYWWGORNLSGDLD-FZKQIMNGSA-N 1 1 394.313 3.183 10 0 GGAEMO COc1cc(CN2CCC[C@H]([N@@H+](C)Cc3cc(OC)ns3)CC2)sn1 ZINC000660126321 567264157 /nfs/dbraw/zinc/26/41/57/567264157.db2.gz WEACJYPNZOHGKS-ZDUSSCGKSA-N 1 1 382.555 3.103 10 0 GGAEMO COc1cc(CN(C)[C@H]2CCC[N@H+](Cc3cc(OC)ns3)CC2)sn1 ZINC000660126321 567264165 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C[C@@]1(C(N)=O)CC[N@@H+](Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000475672130 567266481 /nfs/dbraw/zinc/26/64/81/567266481.db2.gz YBWXYCCIMOYRNH-MRXNPFEDSA-N 1 1 380.311 3.270 10 0 GGAEMO NC(=O)C[C@H]1CCCC[N@@H+]1Cc1cc(Br)cc(Br)c1 ZINC000685411420 567271702 /nfs/dbraw/zinc/27/17/02/567271702.db2.gz MFXHGETXRMJXCW-CYBMUJFWSA-N 1 1 390.119 3.442 10 0 GGAEMO NC(=O)C[C@H]1CCCC[N@H+]1Cc1cc(Br)cc(Br)c1 ZINC000685411420 567271704 /nfs/dbraw/zinc/27/17/04/567271704.db2.gz MFXHGETXRMJXCW-CYBMUJFWSA-N 1 1 390.119 3.442 10 0 GGAEMO O[C@@H](COc1ccc(Br)cc1)C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000475739383 567271755 /nfs/dbraw/zinc/27/17/55/567271755.db2.gz NQDLEIAZALRJJE-SJLPKXTDSA-N 1 1 384.314 3.081 10 0 GGAEMO O=C(CSc1cccc(Br)c1)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC000567732554 567271868 /nfs/dbraw/zinc/27/18/68/567271868.db2.gz DASVPWUNALLUHU-MRXNPFEDSA-N 1 1 392.322 3.109 10 0 GGAEMO Brc1ccc(-c2nnc(C[N@@H+]3CCC[C@@]4(CCCOC4)C3)o2)o1 ZINC000475743600 567272001 /nfs/dbraw/zinc/27/20/01/567272001.db2.gz 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ZINC000617001094 567275137 /nfs/dbraw/zinc/27/51/37/567275137.db2.gz IKSSGGYGVPZZNP-LLVKDONJSA-N 1 1 379.302 3.176 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@H](CNC(=O)c2cc(Br)cc3nc[nH]c32)C1 ZINC000617001094 567275143 /nfs/dbraw/zinc/27/51/43/567275143.db2.gz IKSSGGYGVPZZNP-LLVKDONJSA-N 1 1 379.302 3.176 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)[C@@H]1CCOc2ccc(Br)cc21 ZINC000617006223 567275560 /nfs/dbraw/zinc/27/55/60/567275560.db2.gz YFXMNXBHCHTTIK-UONOGXRCSA-N 1 1 381.314 3.304 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)Cc1c[nH]c2cc(Br)ccc12 ZINC000617012312 567275634 /nfs/dbraw/zinc/27/56/34/567275634.db2.gz YPVGQESMLFQTGS-AWEZNQCLSA-N 1 1 378.314 3.462 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1[nH]nc(-c2ccccc2)c1Br ZINC000617015287 567275658 /nfs/dbraw/zinc/27/56/58/567275658.db2.gz ZBUGDIPBUHKNLK-CYBMUJFWSA-N 1 1 391.313 3.442 10 0 GGAEMO O=C(CC(F)(F)F)NC[C@@H]1CCC[N@H+](Cc2nc3c(s2)CCCC3)C1 ZINC000685437215 567276059 /nfs/dbraw/zinc/27/60/59/567276059.db2.gz DJMZAKZSPQZGBI-LBPRGKRZSA-N 1 1 375.460 3.303 10 0 GGAEMO O=C(CC(F)(F)F)NC[C@@H]1CCC[N@@H+](Cc2nc3c(s2)CCCC3)C1 ZINC000685437215 567276067 /nfs/dbraw/zinc/27/60/67/567276067.db2.gz DJMZAKZSPQZGBI-LBPRGKRZSA-N 1 1 375.460 3.303 10 0 GGAEMO COc1nsc(CNC[C@@H](c2cccs2)[NH+](C)C)c1Br ZINC000638861871 567276416 /nfs/dbraw/zinc/27/64/16/567276416.db2.gz AXARELDOULDYIS-VIFPVBQESA-N 1 1 376.345 3.368 10 0 GGAEMO Fc1ccc(C[NH+]2CC(C3CCOCC3)C2)c(I)c1 ZINC000591356709 567278091 /nfs/dbraw/zinc/27/80/91/567278091.db2.gz QHKCGEKMBRJZKP-UHFFFAOYSA-N 1 1 375.225 3.289 10 0 GGAEMO CCOc1c(Br)cc(C(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc1OC ZINC000617021216 567278297 /nfs/dbraw/zinc/27/82/97/567278297.db2.gz STLOQOBTEZEBQV-ZDUSSCGKSA-N 1 1 399.329 3.459 10 0 GGAEMO C[C@H]1CC(=O)NCC[N@@H+]1Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000685468556 567278496 /nfs/dbraw/zinc/27/84/96/567278496.db2.gz YZRNVAGRCJFZAP-NSHDSACASA-N 1 1 380.311 3.283 10 0 GGAEMO C[C@H]1CC(=O)NCC[N@H+]1Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000685468556 567278501 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C[C@@H]1C[C@@H](N(C)C(=O)Cc2c(F)ccc(Br)c2F)CC[N@H+]1C ZINC000499888464 567281280 /nfs/dbraw/zinc/28/12/80/567281280.db2.gz RSGCVJXMPFMQQW-MNOVXSKESA-N 1 1 375.257 3.211 10 0 GGAEMO C[C@@H](NS(=O)(=O)c1ccc2ncsc2c1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000548123785 567282099 /nfs/dbraw/zinc/28/20/99/567282099.db2.gz KFSXEBYFONWOJB-KGLIPLIRSA-N 1 1 379.551 3.228 10 0 GGAEMO C[N@@H+]1CCO[C@H](CSCC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000567850043 567282755 /nfs/dbraw/zinc/28/27/55/567282755.db2.gz YVDMLYHPJBEVOH-NSHDSACASA-N 1 1 382.835 3.361 10 0 GGAEMO C[N@H+]1CCO[C@H](CSCC(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000567850043 567282760 /nfs/dbraw/zinc/28/27/60/567282760.db2.gz YVDMLYHPJBEVOH-NSHDSACASA-N 1 1 382.835 3.361 10 0 GGAEMO O=S1(=O)C[C@@H](C[NH2+]Cc2cc(Cl)sc2Cl)Oc2ccccc21 ZINC000567853878 567282774 /nfs/dbraw/zinc/28/27/74/567282774.db2.gz RJWNWPAUGDTJCL-SNVBAGLBSA-N 1 1 378.302 3.379 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)N(C)Cc1ccc(Br)cc1C ZINC000433926906 567283553 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C[NH+](C)[C@@H](CNC(=O)Cc1c(F)ccc(Br)c1F)c1ccco1 ZINC000499934428 567285906 /nfs/dbraw/zinc/28/59/06/567285906.db2.gz HPUBPWDDMJVLDQ-ZDUSSCGKSA-N 1 1 387.224 3.282 10 0 GGAEMO C[C@@H](NC(=O)C[N@H+]1CC[C@H](O)CC12CCC2)c1ccc(Br)cc1 ZINC000567885888 567286427 /nfs/dbraw/zinc/28/64/27/567286427.db2.gz APKGIRXPWMYPTK-CJNGLKHVSA-N 1 1 381.314 3.006 10 0 GGAEMO C[NH+](C)[C@@H](CNC(=O)c1cc(Br)cc2nc[nH]c21)c1cccs1 ZINC000499950622 567287260 /nfs/dbraw/zinc/28/72/60/567287260.db2.gz QZCVFMXFMPJIHT-ZDUSSCGKSA-N 1 1 393.310 3.420 10 0 GGAEMO CC[C@H]([NH2+]Cc1coc(S(N)(=O)=O)c1)c1cc(F)cc(Br)c1 ZINC000660324064 567287498 /nfs/dbraw/zinc/28/74/98/567287498.db2.gz YJXIHPYSSNLNQI-ZDUSSCGKSA-N 1 1 391.262 3.070 10 0 GGAEMO CCO[C@H]1C[C@](CO)([NH2+]Cc2ncc(Br)cc2Cl)C1(C)C ZINC000660371470 567289911 /nfs/dbraw/zinc/28/99/11/567289911.db2.gz QLSQZQQBKGPWKA-DZGCQCFKSA-N 1 1 377.710 3.153 10 0 GGAEMO COC[C@H](C[N@H+]1CCC[C@@H]1c1nc(-c2ccccc2Br)no1)OC ZINC000660383190 567291111 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Cc1cc(CN2CCN(C[C@H]3CCCC[N@@H+]3C)CC2)ccc1Br ZINC000500091217 567299262 /nfs/dbraw/zinc/29/92/62/567299262.db2.gz MHNLBDASINQESS-GOSISDBHSA-N 1 1 380.374 3.359 10 0 GGAEMO CC(=O)c1[nH]c(CC[NH2+][C@@H]2CCOc3c(Br)cccc32)nc1C ZINC000660479160 567299991 /nfs/dbraw/zinc/29/99/91/567299991.db2.gz FRPJVRZRMIZYNT-CQSZACIVSA-N 1 1 378.270 3.339 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)Nc1c(C)ccc(F)c1Br ZINC000455744288 567300463 /nfs/dbraw/zinc/30/04/63/567300463.db2.gz FEJTZNZRSWWINK-LBPRGKRZSA-N 1 1 388.281 3.129 10 0 GGAEMO CNS(=O)(=O)c1ccc(C[N@H+]2CC[C@@H](C(F)(F)F)C3(CCC3)C2)cc1 ZINC000660489349 567301223 /nfs/dbraw/zinc/30/12/23/567301223.db2.gz WDCGALWPGZFDDL-OAHLLOKOSA-N 1 1 376.444 3.149 10 0 GGAEMO CN1CC[C@H]([NH2+]Cc2nnc(C(F)(F)F)s2)[C@@H]1c1ccc(F)c(F)c1 ZINC000660487412 567301401 /nfs/dbraw/zinc/30/14/01/567301401.db2.gz CTCGXQGWXCPFCJ-AAEUAGOBSA-N 1 1 378.370 3.370 10 0 GGAEMO CC(C)(C)[C@H]1CC[N@H+](Cc2cn(-c3ccccc3Br)nn2)C[C@H]1O ZINC000685842613 567302360 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C[N@H+]1CCC[C@@H](NC(=O)c2ccc(COc3ccc(Br)cc3)o2)C1 ZINC000617415496 567306703 /nfs/dbraw/zinc/30/67/03/567306703.db2.gz DNZXGLVPUSRWBI-CQSZACIVSA-N 1 1 393.281 3.445 10 0 GGAEMO C[N@H+]1CCC[C@@H](NC(=O)COc2ccc3cc(Br)ccc3c2)C1 ZINC000617416020 567307855 /nfs/dbraw/zinc/30/78/55/567307855.db2.gz YPWIAIPWRAWSJA-MRXNPFEDSA-N 1 1 377.282 3.192 10 0 GGAEMO CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)C(=O)CC(F)(F)C[NH3+] ZINC000568148140 567307790 /nfs/dbraw/zinc/30/77/90/567307790.db2.gz KVAIMJOJGOFFLZ-UHFFFAOYSA-N 1 1 382.238 3.155 10 0 GGAEMO C[C@H](NC(=O)[C@H](c1ccc(Cl)cc1)[NH+](C)C)c1ncc(Br)cn1 ZINC000568170233 567308747 /nfs/dbraw/zinc/30/87/47/567308747.db2.gz GOERAHXEZURPON-HZMBPMFUSA-N 1 1 397.704 3.373 10 0 GGAEMO COc1cccc(N2C[C@@H]([NH2+]Cc3sccc3Br)CC2=O)c1 ZINC000500256328 567308885 /nfs/dbraw/zinc/30/88/85/567308885.db2.gz COCYENHINHEGTR-NSHDSACASA-N 1 1 381.295 3.414 10 0 GGAEMO Cc1ccc2c(c1Br)CN(C(=O)N[C@@H]1CC[N@H+]3CCCC[C@@H]13)C2 ZINC000660571479 567309326 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Nc1ccc(C[N@H+]2CCC[C@@H]2c2ccccc2I)cn1 ZINC000592432729 567338209 /nfs/dbraw/zinc/33/82/09/567338209.db2.gz SBKDJDPTYKNQMG-OAHLLOKOSA-N 1 1 379.245 3.436 10 0 GGAEMO Cc1nnc(CN(C)C(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)s1 ZINC000660962872 567338953 /nfs/dbraw/zinc/33/89/53/567338953.db2.gz ILJHFSPMAUTIOG-GOEBONIOSA-N 1 1 379.917 3.087 10 0 GGAEMO Cc1nnc(CN(C)C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)cc2)s1 ZINC000660962872 567338959 /nfs/dbraw/zinc/33/89/59/567338959.db2.gz ILJHFSPMAUTIOG-GOEBONIOSA-N 1 1 379.917 3.087 10 0 GGAEMO OC[C@@H]1C[N@@H+](CCc2nc(-c3cccc(Cl)c3)no2)C[C@H]1C(F)(F)F ZINC000640042052 567339226 /nfs/dbraw/zinc/33/92/26/567339226.db2.gz LMUZWMLQXNTFJK-WCQYABFASA-N 1 1 375.778 3.035 10 0 GGAEMO C[C@H](NC(=O)N1CCOc2cc(Br)ccc2C1)C1=CC[N@@H+](C)CC1 ZINC000661009339 567339851 /nfs/dbraw/zinc/33/98/51/567339851.db2.gz HQYIQODRQDVRQP-ZDUSSCGKSA-N 1 1 394.313 3.004 10 0 GGAEMO CC[C@@H](C)C(=O)N1CSC[C@H]1C(=O)Nc1ccc(Cl)c(C[NH+](C)C)c1 ZINC000500749631 567341890 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3.130 10 0 GGAEMO C[C@H](CNC(=O)N1CCc2ccc(F)c(Br)c2C1)[N@@H+](C)C1CC1 ZINC000527592896 567344495 /nfs/dbraw/zinc/34/44/95/567344495.db2.gz DZZYHGYKNYUDKW-LLVKDONJSA-N 1 1 384.293 3.139 10 0 GGAEMO C[C@@H](CNC(=O)N1CCc2ccc(F)c(Br)c2C1)[N@@H+](C)C1CC1 ZINC000527592897 567344522 /nfs/dbraw/zinc/34/45/22/567344522.db2.gz DZZYHGYKNYUDKW-NSHDSACASA-N 1 1 384.293 3.139 10 0 GGAEMO C[C@@H](CNC(=O)Cc1ccc(Br)cc1O)[N@@H+](C)Cc1ccccc1 ZINC000548730855 567344693 /nfs/dbraw/zinc/34/46/93/567344693.db2.gz NHZBZDZSXAHTDB-AWEZNQCLSA-N 1 1 391.309 3.334 10 0 GGAEMO C[N@H+]1CCC[C@H]1CNC(=O)N1CCC[C@@H](c2nc(C(F)(F)F)cs2)C1 ZINC000435173444 567344946 /nfs/dbraw/zinc/34/49/46/567344946.db2.gz LPEVADKHEAZHCN-NEPJUHHUSA-N 1 1 376.448 3.145 10 0 GGAEMO CCC[N@H+]1CC[C@@H](CNC(=O)N2CCc3ccc(F)c(Br)c3C2)C1 ZINC000527594152 567344931 /nfs/dbraw/zinc/34/49/31/567344931.db2.gz MGPYSIRGUWVXAW-ZDUSSCGKSA-N 1 1 398.320 3.388 10 0 GGAEMO CCN(C(=O)c1cc(=O)[nH]c2ccc(Br)cc21)[C@H]1CC[N@@H+](CC)C1 ZINC000617927993 567346004 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10 0 GGAEMO CCN(C(=O)[C@H](C)NC(=O)c1cccc(Cl)c1Cl)[C@H]1CC[N@@H+](CC)C1 ZINC000617930682 567347154 /nfs/dbraw/zinc/34/71/54/567347154.db2.gz GEMQGZUQZCWKPK-STQMWFEESA-N 1 1 386.323 3.054 10 0 GGAEMO CCN(C(=O)Cc1c[nH]c2cc(Br)ccc12)[C@H]1CC[N@@H+](CC)C1 ZINC000617927257 567347202 /nfs/dbraw/zinc/34/72/02/567347202.db2.gz UFSLEEFWVUQPTL-HNNXBMFYSA-N 1 1 378.314 3.416 10 0 GGAEMO CC[N@@H+](CCNC(=O)Nc1ccc(Br)c(C(=O)OC)c1)C(C)C ZINC000548737386 567347266 /nfs/dbraw/zinc/34/72/66/567347266.db2.gz CAGVRAXXKQZZKU-UHFFFAOYSA-N 1 1 386.290 3.088 10 0 GGAEMO CN(C)S(=O)(=O)[C@H]1CCC[N@H+](Cc2ccc(F)c(-c3cccs3)c2)C1 ZINC000568682306 567347959 /nfs/dbraw/zinc/34/79/59/567347959.db2.gz SQSBJIVCYQJVHT-HNNXBMFYSA-N 1 1 382.526 3.410 10 0 GGAEMO CN(C)S(=O)(=O)[C@H]1CCC[N@@H+](Cc2ccc(F)c(-c3cccs3)c2)C1 ZINC000568682306 567347968 /nfs/dbraw/zinc/34/79/68/567347968.db2.gz SQSBJIVCYQJVHT-HNNXBMFYSA-N 1 1 382.526 3.410 10 0 GGAEMO Cc1nc(S(=O)(=O)NC[C@H](c2ccc(C)cc2)[NH+]2CCCC2)sc1C ZINC000435218067 567349500 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GGAEMO O=C(CCC[N@H+]1CC[C@H](Cn2ccnn2)C1)c1ccc(Br)cc1 ZINC000661138960 567351587 /nfs/dbraw/zinc/35/15/87/567351587.db2.gz FXSGATUOWYSHMW-AWEZNQCLSA-N 1 1 377.286 3.026 10 0 GGAEMO C[C@H](O)C[N@@H+]1CCN(C(=O)c2cc(Br)cc3ccccc32)[C@H](C)C1 ZINC000476844174 567352450 /nfs/dbraw/zinc/35/24/50/567352450.db2.gz DOPPYZDCZXLMNB-KGLIPLIRSA-N 1 1 391.309 3.129 10 0 GGAEMO C[C@H](O)C[N@H+]1CCN(C(=O)c2cc(Br)cc3ccccc32)[C@H](C)C1 ZINC000476844174 567352456 /nfs/dbraw/zinc/35/24/56/567352456.db2.gz DOPPYZDCZXLMNB-KGLIPLIRSA-N 1 1 391.309 3.129 10 0 GGAEMO Brc1cccc(-c2cnc(C[N@H+]3CC[C@H](Cn4ccnn4)C3)o2)c1 ZINC000661145598 567352503 /nfs/dbraw/zinc/35/25/03/567352503.db2.gz UPFCFAXNAHZIBG-ZDUSSCGKSA-N 1 1 388.269 3.218 10 0 GGAEMO Clc1cccc(Cl)c1-c1nnc(C[N@@H+]2CC[C@@H](Cn3ccnn3)C2)o1 ZINC000661142473 567353315 /nfs/dbraw/zinc/35/33/15/567353315.db2.gz BMDADCUSXCBCFK-LLVKDONJSA-N 1 1 379.251 3.157 10 0 GGAEMO Clc1cccc(Cl)c1-c1nnc(C[N@H+]2CC[C@@H](Cn3ccnn3)C2)o1 ZINC000661142473 567353322 /nfs/dbraw/zinc/35/33/22/567353322.db2.gz BMDADCUSXCBCFK-LLVKDONJSA-N 1 1 379.251 3.157 10 0 GGAEMO C[C@]1(C2CC2)C[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)CCO1 ZINC000661171542 567354546 /nfs/dbraw/zinc/35/45/46/567354546.db2.gz XGVSWQVMZJALPK-QGZVFWFLSA-N 1 1 385.277 3.418 10 0 GGAEMO Cc1cc(Br)c(C[NH2+][C@@H]2CCCCNC2=O)cc1Br ZINC000527637384 567354973 /nfs/dbraw/zinc/35/49/73/567354973.db2.gz ZQPBVAKYTKYWRN-CYBMUJFWSA-N 1 1 390.119 3.278 10 0 GGAEMO C[C@H](CCSc1ccccc1)[N@@H+]1C[C@H](C(F)(F)F)[C@@H](S(C)(=O)=O)C1 ZINC000661188202 567355877 /nfs/dbraw/zinc/35/58/77/567355877.db2.gz XNJPRILSBVMZMG-SNPRPXQTSA-N 1 1 381.485 3.465 10 0 GGAEMO C[C@H](CCSc1ccccc1)[N@H+]1C[C@H](C(F)(F)F)[C@@H](S(C)(=O)=O)C1 ZINC000661188202 567355883 /nfs/dbraw/zinc/35/58/83/567355883.db2.gz XNJPRILSBVMZMG-SNPRPXQTSA-N 1 1 381.485 3.465 10 0 GGAEMO CC(C)[N@H+](C)C[C@H](C)NC(=O)N1CCOc2cc(Br)ccc2C1 ZINC000661198034 567355976 /nfs/dbraw/zinc/35/59/76/567355976.db2.gz IXDDEQVMFSQQAV-ZDUSSCGKSA-N 1 1 384.318 3.082 10 0 GGAEMO CN(c1ccc(C[NH2+]Cc2ccsc2Br)cc1)S(C)(=O)=O ZINC000527659909 567356630 /nfs/dbraw/zinc/35/66/30/567356630.db2.gz UBDBDEKACAARKA-UHFFFAOYSA-N 1 1 389.340 3.196 10 0 GGAEMO OC[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@@H]1NCc1ccsc1Br ZINC000527663896 567357772 /nfs/dbraw/zinc/35/77/72/567357772.db2.gz GJJCHRSACDWWNO-IRXDYDNUSA-N 1 1 395.366 3.483 10 0 GGAEMO OC[C@@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1ccsc1Br ZINC000527663894 567357890 /nfs/dbraw/zinc/35/78/90/567357890.db2.gz GJJCHRSACDWWNO-DLBZAZTESA-N 1 1 395.366 3.483 10 0 GGAEMO C[C@@]1(Cc2ccccc2Cl)CCC[N@H+]1C[C@H]1CCCN(S(C)(=O)=O)C1 ZINC000661208646 567357951 /nfs/dbraw/zinc/35/79/51/567357951.db2.gz BERXIEBFFXSOLU-APWZRJJASA-N 1 1 384.973 3.409 10 0 GGAEMO OC[C@H]1CC[N@H+](Cc2ccccc2)C[C@@H]1NCc1ccsc1Br ZINC000527667563 567357919 /nfs/dbraw/zinc/35/79/19/567357919.db2.gz XTFVINVMEVAVNL-SJORKVTESA-N 1 1 395.366 3.483 10 0 GGAEMO OC[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1NCc1ccsc1Br ZINC000527667563 567357926 /nfs/dbraw/zinc/35/79/26/567357926.db2.gz XTFVINVMEVAVNL-SJORKVTESA-N 1 1 395.366 3.483 10 0 GGAEMO COc1ccc(Br)c(CNC(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1 ZINC000527668504 567358396 /nfs/dbraw/zinc/35/83/96/567358396.db2.gz GWUQLOZHUJVMBX-HNNXBMFYSA-N 1 1 396.329 3.274 10 0 GGAEMO O[C@@]1(CNCc2ccsc2Br)CC[N@@H+](Cc2ccccc2)C1 ZINC000527665802 567358698 /nfs/dbraw/zinc/35/86/98/567358698.db2.gz QAHQVFSBAWOTCB-QGZVFWFLSA-N 1 1 381.339 3.237 10 0 GGAEMO COC(=O)c1ccc(Br)cc1C[N@@H+]1CC[C@H](Cc2cnn(C)c2)C1 ZINC000548918251 567360154 /nfs/dbraw/zinc/36/01/54/567360154.db2.gz IVNGPDGTEYBKFL-CYBMUJFWSA-N 1 1 392.297 3.034 10 0 GGAEMO COC(=O)c1ccc(Br)cc1C[N@H+]1CC[C@H](Cc2cnn(C)c2)C1 ZINC000548918251 567360158 /nfs/dbraw/zinc/36/01/58/567360158.db2.gz IVNGPDGTEYBKFL-CYBMUJFWSA-N 1 1 392.297 3.034 10 0 GGAEMO CCc1[nH+]ccn1[C@@H](C)CC(=O)Nc1cc(I)ccc1O ZINC000592780594 567361927 /nfs/dbraw/zinc/36/19/27/567361927.db2.gz OBRREIATDXGXMC-JTQLQIEISA-N 1 1 399.232 3.346 10 0 GGAEMO COc1cccc(CS(=O)(=O)N[C@@H](C[NH+](C)C)c2ccc(Cl)cc2)c1 ZINC000548980943 567364405 /nfs/dbraw/zinc/36/44/05/567364405.db2.gz OFVVXICUKUPCHL-SFHVURJKSA-N 1 1 382.913 3.071 10 0 GGAEMO C[C@H]1[C@H]([NH2+]Cc2ncc(Br)cc2F)CC(=O)N1Cc1ccccc1 ZINC000527703125 567365224 /nfs/dbraw/zinc/36/52/24/567365224.db2.gz LGDSSYNIGSBQCO-BLLLJJGKSA-N 1 1 392.272 3.262 10 0 GGAEMO Cc1cc(Br)c(C[NH2+][C@@H](C)C(=O)N(C)C)cc1Br ZINC000527700232 567365345 /nfs/dbraw/zinc/36/53/45/567365345.db2.gz NSFLQNSDBXBQPA-VIFPVBQESA-N 1 1 378.108 3.086 10 0 GGAEMO C[N@H+]1CCC[C@@H](CCNC(=O)N2CCOc3cc(Br)ccc3C2)C1 ZINC000661316844 567365932 /nfs/dbraw/zinc/36/59/32/567365932.db2.gz XUJSCTDIVOODDZ-AWEZNQCLSA-N 1 1 396.329 3.085 10 0 GGAEMO CS(=O)(=O)[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc(Br)c(F)c1F ZINC000527709094 567365993 /nfs/dbraw/zinc/36/59/93/567365993.db2.gz DZGNJEYOXGPDSV-VXGBXAGGSA-N 1 1 382.270 3.173 10 0 GGAEMO C[N@H+]1CCCC[C@H]1CN1CCN(C(=O)c2cc(F)c(Cl)cc2Cl)CC1 ZINC000501110600 567366089 /nfs/dbraw/zinc/36/60/89/567366089.db2.gz KIXYZTFEYSMFBL-ZDUSSCGKSA-N 1 1 388.314 3.375 10 0 GGAEMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000456372114 567367270 /nfs/dbraw/zinc/36/72/70/567367270.db2.gz HHKXWTSYKRGFCC-CYBMUJFWSA-N 1 1 392.297 3.259 10 0 GGAEMO CC[C@@H]([NH2+]Cc1cc(Br)c(C)cc1Br)C(=O)NC ZINC000527715213 567368219 /nfs/dbraw/zinc/36/82/19/567368219.db2.gz FNQFAQPQZBIJBG-GFCCVEGCSA-N 1 1 378.108 3.134 10 0 GGAEMO CCCN(C(=O)c1cc(C)ccc1I)[C@@H]1CC[N@@H+](C)C1 ZINC000592830942 567368314 /nfs/dbraw/zinc/36/83/14/567368314.db2.gz ISCYGGYGYALADI-CYBMUJFWSA-N 1 1 386.277 3.156 10 0 GGAEMO CCCN(C(=O)c1cc(C)ccc1I)[C@H]1CC[N@@H+](C)C1 ZINC000592830943 567368515 /nfs/dbraw/zinc/36/85/15/567368515.db2.gz ISCYGGYGYALADI-ZDUSSCGKSA-N 1 1 386.277 3.156 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)NCCc1ccccc1Br ZINC000549030945 567369183 /nfs/dbraw/zinc/36/91/83/567369183.db2.gz CMJICGPRDVBJNY-ZDUSSCGKSA-N 1 1 379.302 3.132 10 0 GGAEMO CSc1ccc(Cl)c(C(=O)N2CCN(C[C@@H]3CCCC[N@H+]3C)CC2)c1 ZINC000501150717 567370121 /nfs/dbraw/zinc/37/01/21/567370121.db2.gz OLSPRHZPHBVQRY-HNNXBMFYSA-N 1 1 381.973 3.304 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1 ZINC000661397949 567371614 /nfs/dbraw/zinc/37/16/14/567371614.db2.gz GKSAXUFFGJKLMX-JTQLQIEISA-N 1 1 375.357 3.386 10 0 GGAEMO O=S(=O)(C1CC1)N1CCC[N@H+](Cc2ccc(-c3ccsc3)cc2)CC1 ZINC000549074195 567371883 /nfs/dbraw/zinc/37/18/83/567371883.db2.gz WUFCQLPYSHFMNI-UHFFFAOYSA-N 1 1 376.547 3.415 10 0 GGAEMO O=S(=O)(C1CC1)N1CCC[N@@H+](Cc2ccc(-c3ccsc3)cc2)CC1 ZINC000549074195 567371885 /nfs/dbraw/zinc/37/18/85/567371885.db2.gz WUFCQLPYSHFMNI-UHFFFAOYSA-N 1 1 376.547 3.415 10 0 GGAEMO COc1ccc(C[NH2+]C[C@H](n2cccn2)C(F)(F)F)c(Br)c1O ZINC000527745956 567371871 /nfs/dbraw/zinc/37/18/71/567371871.db2.gz UAXPUUXZQQYGJA-NSHDSACASA-N 1 1 394.191 3.253 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)N[C@H](C)Cc1ccc(Cl)cc1Cl ZINC000477130960 567372227 /nfs/dbraw/zinc/37/22/27/567372227.db2.gz BNSIRBRUAJQUTO-CZUORRHYSA-N 1 1 388.339 3.334 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)N[C@H](c1cncc(Br)c1)C1CC1 ZINC000661404764 567372653 /nfs/dbraw/zinc/37/26/53/567372653.db2.gz QYBQEXWDXHSIGI-HOTGVXAUSA-N 1 1 395.345 3.467 10 0 GGAEMO CN(Cc1ccccc1)C[C@H](O)C[N@@H+](C)CCc1ccc(Br)cc1 ZINC000592894175 567372729 /nfs/dbraw/zinc/37/27/29/567372729.db2.gz MTMQHVJGZGDZBM-HXUWFJFHSA-N 1 1 391.353 3.416 10 0 GGAEMO CN(CCc1ccc(Br)cc1)C[C@@H](O)C[N@H+](C)Cc1ccccc1 ZINC000592894175 567372736 /nfs/dbraw/zinc/37/27/36/567372736.db2.gz MTMQHVJGZGDZBM-HXUWFJFHSA-N 1 1 391.353 3.416 10 0 GGAEMO CN(CCc1ccc(Br)cc1)C[C@@H](O)C[N@@H+](C)Cc1ccccc1 ZINC000592894175 567372742 /nfs/dbraw/zinc/37/27/42/567372742.db2.gz MTMQHVJGZGDZBM-HXUWFJFHSA-N 1 1 391.353 3.416 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)N[C@H](c1cncc(Br)c1)C1CC1 ZINC000661404763 567372811 /nfs/dbraw/zinc/37/28/11/567372811.db2.gz QYBQEXWDXHSIGI-CVEARBPZSA-N 1 1 395.345 3.467 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)N[C@H](C)Cc1ccc(Cl)cc1Cl ZINC000477130959 567372858 /nfs/dbraw/zinc/37/28/58/567372858.db2.gz BNSIRBRUAJQUTO-CJNGLKHVSA-N 1 1 388.339 3.334 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)NCC(=O)Nc1cc(Cl)ccc1Cl ZINC000661398931 567373198 /nfs/dbraw/zinc/37/31/98/567373198.db2.gz WWDQBNJLHLYEQT-LBPRGKRZSA-N 1 1 387.311 3.104 10 0 GGAEMO CC1(C)OC[C@H]2C[C@]21[NH2+]Cc1ncc(Br)cc1Br ZINC000527765713 567373417 /nfs/dbraw/zinc/37/34/17/567373417.db2.gz JSCQYRXYWZWPQE-OQPBUACISA-N 1 1 376.092 3.264 10 0 GGAEMO C[C@@H](NC(=O)NC[C@@H]1CCC[N@H+]1C)c1cc(F)c(Br)cc1F ZINC000527799628 567374675 /nfs/dbraw/zinc/37/46/75/567374675.db2.gz YBWQPMWNTNWWDF-ZJUUUORDSA-N 1 1 376.245 3.182 10 0 GGAEMO CC(C)[N@H+]1CC[C@H](CNC(=O)NCc2ccc(Br)c(F)c2F)C1 ZINC000527797735 567374976 /nfs/dbraw/zinc/37/49/76/567374976.db2.gz DHIFCGVMYSSLMK-LLVKDONJSA-N 1 1 390.272 3.257 10 0 GGAEMO C[C@@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCc1cc(F)c(Br)cc1F ZINC000527820517 567376207 /nfs/dbraw/zinc/37/62/07/567376207.db2.gz LXIQKSXXSPPLMW-RFAUZJTJSA-N 1 1 388.256 3.009 10 0 GGAEMO C[C@@]12COC[C@]1(C)C[N@@H+](Cc1nc(-c3ccc(Br)s3)no1)C2 ZINC000661500697 567376946 /nfs/dbraw/zinc/37/69/46/567376946.db2.gz GWLURESAOFXUOB-GASCZTMLSA-N 1 1 384.299 3.419 10 0 GGAEMO C[C@@]12COC[C@]1(C)C[N@H+](Cc1nc(-c3ccc(Br)s3)no1)C2 ZINC000661500697 567376949 /nfs/dbraw/zinc/37/69/49/567376949.db2.gz GWLURESAOFXUOB-GASCZTMLSA-N 1 1 384.299 3.419 10 0 GGAEMO C[C@@H]1C[C@H](NC(=O)NCc2ccc(Br)c(F)c2F)C[N@H+]1C1CC1 ZINC000527814331 567377055 /nfs/dbraw/zinc/37/70/55/567377055.db2.gz SWAZBYGVLHIFRY-KOLCDFICSA-N 1 1 388.256 3.152 10 0 GGAEMO C[C@H]1C[N@H+](C2CC2)C[C@H]1NC(=O)NCc1cc(F)c(Br)cc1F ZINC000527820515 567377150 /nfs/dbraw/zinc/37/71/50/567377150.db2.gz LXIQKSXXSPPLMW-BJOHPYRUSA-N 1 1 388.256 3.009 10 0 GGAEMO O=C(N[C@H]1CSCc2ccc(Br)cc21)[C@@H]1CCC[N@@H+]1C1CC1 ZINC000618360146 567377689 /nfs/dbraw/zinc/37/76/89/567377689.db2.gz KZEOVVJQSOPTRC-HOTGVXAUSA-N 1 1 381.339 3.480 10 0 GGAEMO O=C(N[C@H]1CSCc2ccc(Br)cc21)[C@@H]1CCC[N@H+]1C1CC1 ZINC000618360146 567377694 /nfs/dbraw/zinc/37/76/94/567377694.db2.gz KZEOVVJQSOPTRC-HOTGVXAUSA-N 1 1 381.339 3.480 10 0 GGAEMO CO[C@@H](C[N@H+]1CCO[C@H](c2ccc(Br)cc2)[C@H]1C)[C@@H]1CCOC1 ZINC000661517988 567378693 /nfs/dbraw/zinc/37/86/93/567378693.db2.gz ZXJTXDLCTJJJLM-WCZJQEMASA-N 1 1 384.314 3.262 10 0 GGAEMO CCN(Cc1cccc(Br)c1)C(=O)NC[C@H]1CCC[N@H+]1CCOC ZINC000477185001 567378939 /nfs/dbraw/zinc/37/89/39/567378939.db2.gz GWLHTPUZMFPHGO-QGZVFWFLSA-N 1 1 398.345 3.091 10 0 GGAEMO Cc1csc(C(=O)N[C@@H]2C[C@@H]([NH+]3CCOCC3)C2(C)C)c1Br ZINC000640510345 567380535 /nfs/dbraw/zinc/38/05/35/567380535.db2.gz APGBBEPFUJCVBS-VXGBXAGGSA-N 1 1 387.343 3.048 10 0 GGAEMO CCN(C)S(=O)(=O)N[C@@H](c1ccc(Cl)cc1)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000549246266 567380996 /nfs/dbraw/zinc/38/09/96/567380996.db2.gz TYNVITQTQDSWBH-ONQFOCNCSA-N 1 1 385.961 3.040 10 0 GGAEMO COC(=O)CC1([NH2+]Cc2cc(Cl)ccc2I)CC1 ZINC000593057906 567382902 /nfs/dbraw/zinc/38/29/02/567382902.db2.gz WIIHEPHNUGQZIO-UHFFFAOYSA-N 1 1 379.625 3.130 10 0 GGAEMO 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375.257 3.022 10 0 GGAEMO C[C@@H]1C[C@@H]([NH+]2CCOCC2)CN1Cc1ccc(Br)c(F)c1F ZINC000528508712 567431849 /nfs/dbraw/zinc/43/18/49/567431849.db2.gz QVLVZFRWRXWHLO-DGCLKSJQSA-N 1 1 375.257 3.022 10 0 GGAEMO C[C@H]1CCCC[C@@H]1OCCNC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000662387173 567431858 /nfs/dbraw/zinc/43/18/58/567431858.db2.gz CBGITUKINBYIPJ-JQWIXIFHSA-N 1 1 387.343 3.439 10 0 GGAEMO COc1ccc(Br)c(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)c1 ZINC000457001466 567432141 /nfs/dbraw/zinc/43/21/41/567432141.db2.gz VULQITQHQHPJSD-KRWDZBQOSA-N 1 1 375.266 3.244 10 0 GGAEMO O=C([C@@H]1COc2ccc(Br)cc21)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000457008413 567432259 /nfs/dbraw/zinc/43/22/59/567432259.db2.gz CKYZMFKSERYJAL-SJORKVTESA-N 1 1 387.277 3.098 10 0 GGAEMO O=C(COc1ccc(F)cc1Br)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000457002331 567432345 /nfs/dbraw/zinc/43/23/45/567432345.db2.gz WFBFVCPUCDOWHR-MRXNPFEDSA-N 1 1 393.256 3.140 10 0 GGAEMO Cc1nocc1C[NH2+][C@H]1CCCN(c2ccc(Br)c(C)c2)C1=O ZINC000550198745 567432299 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Cc1cc([C@H]2CCCN2C(=O)c2sc3c(c2Br)C[NH2+]C3)on1 ZINC000662388956 567433644 /nfs/dbraw/zinc/43/36/44/567433644.db2.gz RCVNFWXQSLUCPN-SNVBAGLBSA-N 1 1 382.283 3.388 10 0 GGAEMO Cc1cccc(CC(=O)N2CCCC[C@@H]2C[NH+]2CCOCC2)c1Br ZINC000528517753 567434391 /nfs/dbraw/zinc/43/43/91/567434391.db2.gz IDQSDUXSABXXHP-QGZVFWFLSA-N 1 1 395.341 3.013 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCCC[C@@H]1c1ncc[nH]1 ZINC000662427581 567436805 /nfs/dbraw/zinc/43/68/05/567436805.db2.gz RFKQHTXSMGIQSN-SNVBAGLBSA-N 1 1 381.299 3.204 10 0 GGAEMO CC(C)[N@H+]1CC[C@@H](CNC(=O)C(=O)Nc2cc(Cl)c(Cl)c(Cl)c2)C1 ZINC000569854158 567437533 /nfs/dbraw/zinc/43/75/33/567437533.db2.gz OWDIKTXBYYPMGI-JTQLQIEISA-N 1 1 392.714 3.432 10 0 GGAEMO Cc1cccc(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1Br ZINC000528551584 567437773 /nfs/dbraw/zinc/43/77/73/567437773.db2.gz NWIMURMCARGBCT-AWEZNQCLSA-N 1 1 387.343 3.053 10 0 GGAEMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1sc2c(c1Br)CNC2 ZINC000662457923 567438181 /nfs/dbraw/zinc/43/81/81/567438181.db2.gz GAOQJXWNCNWIRK-LLVKDONJSA-N 1 1 386.359 3.108 10 0 GGAEMO COc1cccc(C[C@H](C)NC(=O)[C@@H]([NH3+])c2ccccc2Br)c1 ZINC000662460408 567439678 /nfs/dbraw/zinc/43/96/78/567439678.db2.gz IQMZQWCUDYZKQL-SJCJKPOMSA-N 1 1 377.282 3.205 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)c1cc(Cl)cc(F)c1Br ZINC000550297416 567440103 /nfs/dbraw/zinc/44/01/03/567440103.db2.gz LVBWLJGCZUVCTQ-NSHDSACASA-N 1 1 393.684 3.082 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(Cl)cc(F)c1Br ZINC000550297415 567440485 /nfs/dbraw/zinc/44/04/85/567440485.db2.gz LVBWLJGCZUVCTQ-LLVKDONJSA-N 1 1 393.684 3.082 10 0 GGAEMO C[C@H](CNc1ccccc1)NC(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000662498243 567440969 /nfs/dbraw/zinc/44/09/69/567440969.db2.gz MZTKKIQFCPDANC-SNVBAGLBSA-N 1 1 380.311 3.344 10 0 GGAEMO C[N@@H+](CCCOc1cccc(I)c1)CC1CCOCC1 ZINC000502535088 567441073 /nfs/dbraw/zinc/44/10/73/567441073.db2.gz VMFZYBJYQAVGPA-UHFFFAOYSA-N 1 1 389.277 3.419 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCO[C@@H](c2ccsc2)C1 ZINC000662498357 567441145 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COc1ccc(CN(C)C(=O)c2sc3c(c2Br)C[NH2+]C3)cc1O ZINC000662500557 567442624 /nfs/dbraw/zinc/44/26/24/567442624.db2.gz NSPXZSQPDVITNZ-UHFFFAOYSA-N 1 1 397.294 3.100 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)[C@H]3C[C@H]3c3ccc(Cl)cc3Cl)[C@H]2C1 ZINC000502567456 567443671 /nfs/dbraw/zinc/44/36/71/567443671.db2.gz BIZDDSPCONWQGE-UOVPBQLFSA-N 1 1 383.319 3.419 10 0 GGAEMO [NH3+][C@H](C(=O)NCc1ccn(C2CCCC2)n1)c1ccccc1Br ZINC000662505636 567443755 /nfs/dbraw/zinc/44/37/55/567443755.db2.gz ZJSXTQYGSBUQRK-INIZCTEOSA-N 1 1 377.286 3.077 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3Cl)[C@H]2C1 ZINC000502567454 567444089 /nfs/dbraw/zinc/44/40/89/567444089.db2.gz BIZDDSPCONWQGE-CIRFHOKZSA-N 1 1 383.319 3.419 10 0 GGAEMO OC[C@@H]1CCC2(CCOCC2)C[N@H+]1CCOc1ccccc1Br ZINC000528646524 567444870 /nfs/dbraw/zinc/44/48/70/567444870.db2.gz WFXYIPRLMJKEGY-HNNXBMFYSA-N 1 1 384.314 3.081 10 0 GGAEMO O=c1cc(C[NH2+][C@H](c2ccccn2)C2CCC2)nc2ccc(Br)cn12 ZINC000528658260 567446202 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3.419 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)[C@H](C)Oc3ccc(Cl)cc3Cl)[C@H]2C1 ZINC000502722256 567448578 /nfs/dbraw/zinc/44/85/78/567448578.db2.gz QZOLREUBRWCEIJ-YLQAJVPDSA-N 1 1 387.307 3.082 10 0 GGAEMO Cc1c(F)c(Br)ccc1C(=O)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC000662563103 567448915 /nfs/dbraw/zinc/44/89/15/567448915.db2.gz ZZTYYYQRFDOUFP-OAHLLOKOSA-N 1 1 378.245 3.078 10 0 GGAEMO CN(C)C(=O)CCC[N@H+]1CCC[C@@H]1c1ccccc1I ZINC000593957754 567449616 /nfs/dbraw/zinc/44/96/16/567449616.db2.gz IJLJKQHXICRPKL-OAHLLOKOSA-N 1 1 386.277 3.297 10 0 GGAEMO [NH3+][C@@H](C(=O)Nc1cc2c([nH]c1=O)CCCC2)c1ccccc1Br ZINC000662580581 567450530 /nfs/dbraw/zinc/45/05/30/567450530.db2.gz ANQIDADEFYEFOJ-OAHLLOKOSA-N 1 1 376.254 3.067 10 0 GGAEMO [NH3+][C@H](C(=O)NCC[C@@H]1CCc2ccccc2N1)c1ccccc1Br ZINC000662585801 567451465 /nfs/dbraw/zinc/45/14/65/567451465.db2.gz XXRLRPSBHPVAIM-KSSFIOAISA-N 1 1 388.309 3.382 10 0 GGAEMO C[C@@H]1CCC[C@@H](C)[NH+]1CCNS(=O)(=O)c1ccc(Br)s1 ZINC000594031262 567453634 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Cc1cc(NC(=O)[C@@H](C)[N@@H+]2CC[C@H]3CC[C@@H](C2)[S@@]3=O)ccc1Br ZINC000528784097 567456933 /nfs/dbraw/zinc/45/69/33/567456933.db2.gz IYPXRMOFZWSNRD-BWZIXVDQSA-N 1 1 399.354 3.070 10 0 GGAEMO Cc1cc(NC(=O)[C@@H](C)[N@H+]2CC[C@H]3CC[C@@H](C2)[S@@]3=O)ccc1Br ZINC000528784097 567456936 /nfs/dbraw/zinc/45/69/36/567456936.db2.gz IYPXRMOFZWSNRD-BWZIXVDQSA-N 1 1 399.354 3.070 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(C)c(Br)c(Cl)c1 ZINC000550690976 567457286 /nfs/dbraw/zinc/45/72/86/567457286.db2.gz UMLNHSYGTZITIM-CYBMUJFWSA-N 1 1 389.721 3.252 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCC(c2ccon2)CC1 ZINC000662712811 567457604 /nfs/dbraw/zinc/45/76/04/567457604.db2.gz KYPDNOFQENTYDH-UHFFFAOYSA-N 1 1 382.283 3.122 10 0 GGAEMO [NH3+][C@H](C(=O)N[C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21)c1ccccc1Br ZINC000662739689 567459200 /nfs/dbraw/zinc/45/92/00/567459200.db2.gz PDRSNBUXHTUPCD-BSWAZPDLSA-N 1 1 375.241 3.043 10 0 GGAEMO COC(=O)[C@@H]([NH2+]CCCC(=O)Nc1c(C)cc(Br)cc1C)C1CC1 ZINC000502880050 567459401 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URFWQWORQXSBHI-RYUDHWBXSA-N 1 1 393.285 3.316 10 0 GGAEMO Cc1ccc(I)c(C(=O)N[C@H]2CCC[N@H+]3CCCC[C@H]23)c1 ZINC000594199382 567464416 /nfs/dbraw/zinc/46/44/16/567464416.db2.gz YFDNNWUZNXVMSI-JKSUJKDBSA-N 1 1 398.288 3.346 10 0 GGAEMO Cn1nccc1[C@H]1CCCCN1C(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000662828425 567464608 /nfs/dbraw/zinc/46/46/08/567464608.db2.gz JKHHIIFMWUMBDE-GFCCVEGCSA-N 1 1 395.326 3.215 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000662826269 567464787 /nfs/dbraw/zinc/46/47/87/567464787.db2.gz YJBLJCDUTWLOSS-RYUDHWBXSA-N 1 1 399.354 3.393 10 0 GGAEMO CC[N@@H+](C)C[C@H]1CCN(C(=O)Cc2c(F)ccc(Br)c2F)C1 ZINC000503024912 567465152 /nfs/dbraw/zinc/46/51/52/567465152.db2.gz RBYDAVPSHLFJCS-LLVKDONJSA-N 1 1 375.257 3.070 10 0 GGAEMO COCC[N@H+]1CCCN(C(=O)CCCOc2cccc(Cl)c2Cl)CC1 ZINC000478536374 567465752 /nfs/dbraw/zinc/46/57/52/567465752.db2.gz PAOHEXSDRNIWAT-UHFFFAOYSA-N 1 1 389.323 3.333 10 0 GGAEMO COCC[N@H+]1CCCN(C(=O)CCCCc2ccc(Br)cc2)CC1 ZINC000478555471 567467061 /nfs/dbraw/zinc/46/70/61/567467061.db2.gz GINTWFUJELSDJP-UHFFFAOYSA-N 1 1 397.357 3.343 10 0 GGAEMO COCC[N@H+]1CCCN(C(=O)C2(c3ccc(Br)cc3)CCC2)CC1 ZINC000478560336 567467128 /nfs/dbraw/zinc/46/71/28/567467128.db2.gz LHQBLTKZNOGEHF-UHFFFAOYSA-N 1 1 395.341 3.052 10 0 GGAEMO C[C@H]1CCCN(S(=O)(=O)NC[C@H](c2ccccc2Cl)[NH+]2CCCC2)C1 ZINC000642099624 567467728 /nfs/dbraw/zinc/46/77/28/567467728.db2.gz ZRPRCHQTPPXHOM-MAUKXSAKSA-N 1 1 385.961 3.043 10 0 GGAEMO C[C@@H]([NH2+]CC(=O)N1CCO[C@@H]2CCCC[C@@H]21)c1ccc(Br)cc1F ZINC000570245199 567468531 /nfs/dbraw/zinc/46/85/31/567468531.db2.gz VUGSEEVZJYJMCN-OAUYIBNBSA-N 1 1 399.304 3.409 10 0 GGAEMO C[C@@H]([NH2+]CC(=O)N1CCO[C@H]2CCCC[C@H]21)c1ccc(Br)cc1F ZINC000570245198 567468754 /nfs/dbraw/zinc/46/87/54/567468754.db2.gz VUGSEEVZJYJMCN-JLZZUVOBSA-N 1 1 399.304 3.409 10 0 GGAEMO COC[C@@H]([NH2+]CC(=O)N1CCC[C@@H](C(F)(F)F)C1)c1cccc(Cl)c1 ZINC000570244512 567469051 /nfs/dbraw/zinc/46/90/51/567469051.db2.gz OEDHUGOVJIBPBH-UKRRQHHQSA-N 1 1 378.822 3.418 10 0 GGAEMO C[C@@H]1CCCN(C(=O)c2[nH]nc3ccc(Br)cc32)[C@@H]1CCC[NH3+] ZINC000662893976 567469116 /nfs/dbraw/zinc/46/91/16/567469116.db2.gz QIRXJIJQBFSBMZ-IAQYHMDHSA-N 1 1 379.302 3.305 10 0 GGAEMO COc1cc(NC(=O)c2c[nH]nc2[C@@H]2CC[NH2+]C2)c(Cl)cc1Br ZINC000662920013 567469128 /nfs/dbraw/zinc/46/91/28/567469128.db2.gz QQQKNOUXEDCGLL-MRVPVSSYSA-N 1 1 399.676 3.163 10 0 GGAEMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)Cc1c(F)ccc(Br)c1F ZINC000503140444 567469740 /nfs/dbraw/zinc/46/97/40/567469740.db2.gz OKJHKDLSFKXLRF-SNVBAGLBSA-N 1 1 386.240 3.227 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H](C)CNC(=O)Cc1c(F)ccc(Br)c1F ZINC000503140443 567469917 /nfs/dbraw/zinc/46/99/17/567469917.db2.gz OKJHKDLSFKXLRF-JTQLQIEISA-N 1 1 386.240 3.227 10 0 GGAEMO COc1cccc(CNC(=O)c2sc3c(c2Br)C[NH2+]C3)c1C ZINC000662947094 567470321 /nfs/dbraw/zinc/47/03/21/567470321.db2.gz KIQQWSPGLHOIGF-UHFFFAOYSA-N 1 1 381.295 3.361 10 0 GGAEMO Cc1cc(CNS(=O)(=O)c2cccc(Cl)c2C)cc(N2CCCC2)[nH+]1 ZINC000570250872 567470376 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C[C@H](CC(=O)N(C)c1ccccc1)[NH2+][C@H](C)c1ncc(Br)cn1 ZINC000551210025 567488330 /nfs/dbraw/zinc/48/83/30/567488330.db2.gz RLSILJIRZVECDO-CHWSQXEVSA-N 1 1 377.286 3.331 10 0 GGAEMO Cn1cc[nH+]c1N1CCC(NC(=O)c2sc3ncccc3c2Cl)CC1 ZINC000529143818 567490760 /nfs/dbraw/zinc/49/07/60/567490760.db2.gz UXUYFKLIHUQGAN-UHFFFAOYSA-N 1 1 375.885 3.082 10 0 GGAEMO COC(=O)c1cc(C[NH2+]CC(=O)Nc2ccc(Br)cc2C)c(C)o1 ZINC000594616641 567492309 /nfs/dbraw/zinc/49/23/09/567492309.db2.gz VKOVLCGBWUUDAH-UHFFFAOYSA-N 1 1 395.253 3.174 10 0 GGAEMO CCc1ccc(S(=O)(=O)N(C)C[C@H]2CC[N@@H+](Cc3ccccc3)C2)s1 ZINC000437333671 567493606 /nfs/dbraw/zinc/49/36/06/567493606.db2.gz ORMBUVONKOLKMI-QGZVFWFLSA-N 1 1 378.563 3.453 10 0 GGAEMO COc1ccc(CN2CC[C@H]([NH2+]Cc3ccsc3Br)C2=O)cc1 ZINC000663299083 567494019 /nfs/dbraw/zinc/49/40/19/567494019.db2.gz DTUIBZCMVYNNBN-HNNXBMFYSA-N 1 1 395.322 3.410 10 0 GGAEMO CN1CC[C@H]([NH2+]C[C@H](CO)Cc2ccc(Br)cc2)[C@@H]2CCC[C@H]21 ZINC000570553180 567495087 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C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)Cc2csc(Cc3cccc(Cl)c3)n2)C1 ZINC000646943412 567750887 /nfs/dbraw/zinc/75/08/87/567750887.db2.gz IPGWOHZERNNPHC-YOEHRIQHSA-N 1 1 375.925 3.092 10 0 GGAEMO C[N@H+]1C[C@H]2CCN(C(=O)Cc3csc(Cc4cccc(Cl)c4)n3)[C@@H]2C1 ZINC000646943410 567751069 /nfs/dbraw/zinc/75/10/69/567751069.db2.gz IPGWOHZERNNPHC-RHSMWYFYSA-N 1 1 375.925 3.092 10 0 GGAEMO CC(C)(C)[C@@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C[C@H]1O ZINC000554854055 567752821 /nfs/dbraw/zinc/75/28/21/567752821.db2.gz KCFOYPAYMZSVFM-SQWLQELKSA-N 1 1 376.324 3.462 10 0 GGAEMO CC(C)(C)[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Cl)cc2Cl)C[C@H]1O ZINC000554854053 567752964 /nfs/dbraw/zinc/75/29/64/567752964.db2.gz KCFOYPAYMZSVFM-IIAWOOMASA-N 1 1 376.324 3.462 10 0 GGAEMO O=C([C@@H]1CCC[N@H+](CCOc2ccc(Br)cc2)C1)N1CCCC1 ZINC000574066839 567753707 /nfs/dbraw/zinc/75/37/07/567753707.db2.gz LIOYVIQZMGQESB-OAHLLOKOSA-N 1 1 381.314 3.162 10 0 GGAEMO C[C@@H]1CSc2ccc(Br)cc2[C@@H]1[NH2+][C@H](CO)c1ccnn1C ZINC000624020780 567754391 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CCN([C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1)S(=O)(=O)c1cnc(C)s1 ZINC000533175458 567756379 /nfs/dbraw/zinc/75/63/79/567756379.db2.gz XRLKBFRSCJKUDU-RHSMWYFYSA-N 1 1 379.551 3.298 10 0 GGAEMO CCN([C@@H]1CC[N@H+]([C@H](C)c2ccccc2)C1)S(=O)(=O)c1cnc(C)s1 ZINC000533175458 567756387 /nfs/dbraw/zinc/75/63/87/567756387.db2.gz XRLKBFRSCJKUDU-RHSMWYFYSA-N 1 1 379.551 3.298 10 0 GGAEMO COC(=O)[C@H]1CC[N@H+](Cc2cc(Br)c(OC(F)F)c(OC)c2)C1 ZINC000508617583 567757090 /nfs/dbraw/zinc/75/70/90/567757090.db2.gz HOCSCVHHKVVHGN-JTQLQIEISA-N 1 1 394.212 3.054 10 0 GGAEMO COC(=O)[C@H]1CC[N@@H+](Cc2cc(Br)c(OC(F)F)c(OC)c2)C1 ZINC000508617583 567757092 /nfs/dbraw/zinc/75/70/92/567757092.db2.gz HOCSCVHHKVVHGN-JTQLQIEISA-N 1 1 394.212 3.054 10 0 GGAEMO C[C@]1(F)C[NH2+]CCN(C(=O)CCc2cc(Cl)ccc2Br)C1 ZINC000647064746 567757118 /nfs/dbraw/zinc/75/71/18/567757118.db2.gz WAGZWJDLCGETIM-HNNXBMFYSA-N 1 1 377.685 3.195 10 0 GGAEMO Cc1nc(S(=O)(=O)N(C)[C@H]2CCC[N@H+](Cc3ccccc3)C2)sc1C ZINC000533253391 567761414 /nfs/dbraw/zinc/76/14/14/567761414.db2.gz LNNWRTRUQSZGJB-KRWDZBQOSA-N 1 1 379.551 3.045 10 0 GGAEMO Cc1nc(S(=O)(=O)N(C)[C@H]2CCC[N@@H+](Cc3ccccc3)C2)sc1C ZINC000533253391 567761421 /nfs/dbraw/zinc/76/14/21/567761421.db2.gz LNNWRTRUQSZGJB-KRWDZBQOSA-N 1 1 379.551 3.045 10 0 GGAEMO C[N@H+](CCc1ccc(Br)cc1)CC(=O)Nc1ccc2c(c1)OCO2 ZINC000533279888 567762086 /nfs/dbraw/zinc/76/20/86/567762086.db2.gz SSGWYDGWGSSQHV-UHFFFAOYSA-N 1 1 391.265 3.291 10 0 GGAEMO C[N@@H+](CCc1ccc(Br)cc1)CC(=O)Nc1ccc2c(c1)OCO2 ZINC000533279888 567762093 /nfs/dbraw/zinc/76/20/93/567762093.db2.gz SSGWYDGWGSSQHV-UHFFFAOYSA-N 1 1 391.265 3.291 10 0 GGAEMO COc1ncc(Br)cc1C[NH2+][C@H](C)c1ccc2c(c1)OCC(=O)N2 ZINC000624133919 567762281 /nfs/dbraw/zinc/76/22/81/567762281.db2.gz ACSLCOHFDORWCS-SNVBAGLBSA-N 1 1 392.253 3.034 10 0 GGAEMO CN(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)[C@H]1CC[N@H+](C2CC2)C1 ZINC000533303241 567763634 /nfs/dbraw/zinc/76/36/34/567763634.db2.gz YCCYKDJWCLMBEU-ZDUSSCGKSA-N 1 1 375.822 3.466 10 0 GGAEMO C[C@@H]1CCC[N@@H+](CCNC(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)C1 ZINC000624138409 567763909 /nfs/dbraw/zinc/76/39/09/567763909.db2.gz MSCNEKZWUZYRBT-UOAMXJAYSA-N 1 1 377.326 3.183 10 0 GGAEMO Fc1cc(C[NH2+]C2CCN([C@@H]3CCOC3)CC2)c(F)cc1Br ZINC000624160906 567765208 /nfs/dbraw/zinc/76/52/08/567765208.db2.gz RIOOIABWYIOAND-CYBMUJFWSA-N 1 1 375.257 3.070 10 0 GGAEMO C[N@@H+](CCCCNC(=O)NCc1ccc(Br)c(F)c1F)C1CC1 ZINC000624185209 567766786 /nfs/dbraw/zinc/76/67/86/567766786.db2.gz JEUJAZLVUDHQTB-UHFFFAOYSA-N 1 1 390.272 3.401 10 0 GGAEMO COc1ncncc1C[NH2+]C1(c2ccc(Br)cc2)CCOCC1 ZINC000647186791 567767354 /nfs/dbraw/zinc/76/73/54/567767354.db2.gz VTDYDVZIAOARIT-UHFFFAOYSA-N 1 1 378.270 3.043 10 0 GGAEMO FC(F)Oc1ccc(Br)c(C[NH2+]CCCCN2CCOCC2)c1 ZINC000647171352 567767771 /nfs/dbraw/zinc/76/77/71/567767771.db2.gz GXHORDINRNIUCX-UHFFFAOYSA-N 1 1 393.272 3.253 10 0 GGAEMO NS(=O)(=O)c1ccc(C[NH2+]C2(c3cccc(Br)c3)CC2)c(F)c1 ZINC000647185449 567767823 /nfs/dbraw/zinc/76/78/23/567767823.db2.gz CEOMDLYVXLUVTN-UHFFFAOYSA-N 1 1 399.285 3.015 10 0 GGAEMO C[N@@H+]1CCO[C@H](CSCc2nc(-c3cccc(Br)c3)no2)C1 ZINC000574277171 567768075 /nfs/dbraw/zinc/76/80/75/567768075.db2.gz RSDQZYPBTBHRNE-ZDUSSCGKSA-N 1 1 384.299 3.063 10 0 GGAEMO C[N@H+]1CCO[C@H](CSCc2nc(-c3cccc(Br)c3)no2)C1 ZINC000574277171 567768082 /nfs/dbraw/zinc/76/80/82/567768082.db2.gz RSDQZYPBTBHRNE-ZDUSSCGKSA-N 1 1 384.299 3.063 10 0 GGAEMO CN(CCn1cc(Br)cn1)c1nc(N2Cc3ccccc3C2)cc[nH+]1 ZINC000624230105 567769093 /nfs/dbraw/zinc/76/90/93/567769093.db2.gz NKESBRAPDCZIKO-UHFFFAOYSA-N 1 1 399.296 3.092 10 0 GGAEMO COc1ncncc1C[NH2+][C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1=O ZINC000647205611 567769767 /nfs/dbraw/zinc/76/97/67/567769767.db2.gz IJRQUPIQAMKDJM-CQSZACIVSA-N 1 1 381.263 3.077 10 0 GGAEMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1cc(F)ccc1I ZINC000598465023 567770306 /nfs/dbraw/zinc/77/03/06/567770306.db2.gz BEKFHJQGTVMPKV-UHFFFAOYSA-N 1 1 392.256 3.281 10 0 GGAEMO C[C@@H]([NH2+]Cc1cc(OC(F)F)ccc1Br)C1(S(C)(=O)=O)CC1 ZINC000647210627 567771860 /nfs/dbraw/zinc/77/18/60/567771860.db2.gz QPAKACUURUFNEZ-SECBINFHSA-N 1 1 398.269 3.106 10 0 GGAEMO COc1ccc(Br)cc1C1([NH2+]Cc2cnc(N(C)C)nc2)CC1 ZINC000647224095 567772485 /nfs/dbraw/zinc/77/24/85/567772485.db2.gz OLPUSGBMXBPNQS-UHFFFAOYSA-N 1 1 377.286 3.093 10 0 GGAEMO CS(=O)(=O)c1cccc(Cl)c1C[NH2+]C[C@@H]1CSc2ccccc2O1 ZINC000647222971 567773062 /nfs/dbraw/zinc/77/30/62/567773062.db2.gz FTIUPZIMKXVOEF-GFCCVEGCSA-N 1 1 383.922 3.386 10 0 GGAEMO C[C@H](c1ccccc1Br)N1CCN(c2cc[nH+]c(N(C)C)n2)CC1 ZINC000533529776 567773124 /nfs/dbraw/zinc/77/31/24/567773124.db2.gz NZFYZOGGFIVTOQ-CQSZACIVSA-N 1 1 390.329 3.188 10 0 GGAEMO C[C@H](C(=O)N1CCC[C@H]1c1nc2cc(Cl)ccc2[nH]1)[NH+]1CCSCC1 ZINC000533548450 567774094 /nfs/dbraw/zinc/77/40/94/567774094.db2.gz AVPUISCJQPMAKL-WBMJQRKESA-N 1 1 378.929 3.317 10 0 GGAEMO FCCC[NH+]1CCN(c2nc(C(F)(F)F)c(Br)s2)CC1 ZINC000624334854 567775273 /nfs/dbraw/zinc/77/52/73/567775273.db2.gz HKJHGJIPRISPPM-UHFFFAOYSA-N 1 1 376.217 3.406 10 0 GGAEMO CSc1cc(Cl)c(C(F)(F)F)cc1NC(=O)N1CC[NH+](CCO)CC1 ZINC000667825268 567775706 /nfs/dbraw/zinc/77/57/06/567775706.db2.gz RXYVPQDRUILSHP-UHFFFAOYSA-N 1 1 397.850 3.223 10 0 GGAEMO CN([C@@H]1CC[N@@H+](C2CC2)C1)S(=O)(=O)c1ccc(C(F)(F)F)cc1Cl ZINC000443787260 567776065 /nfs/dbraw/zinc/77/60/65/567776065.db2.gz GGNNTTSEFCJEGH-GFCCVEGCSA-N 1 1 382.835 3.216 10 0 GGAEMO CN([C@@H]1CC[N@H+](C2CC2)C1)S(=O)(=O)c1ccc(C(F)(F)F)cc1Cl ZINC000443787260 567776068 /nfs/dbraw/zinc/77/60/68/567776068.db2.gz GGNNTTSEFCJEGH-GFCCVEGCSA-N 1 1 382.835 3.216 10 0 GGAEMO CN([C@H]1CC[N@@H+](C2CC2)C1)S(=O)(=O)c1ccc(C(F)(F)F)cc1Cl ZINC000443787262 567776129 /nfs/dbraw/zinc/77/61/29/567776129.db2.gz GGNNTTSEFCJEGH-LBPRGKRZSA-N 1 1 382.835 3.216 10 0 GGAEMO CN([C@H]1CC[N@H+](C2CC2)C1)S(=O)(=O)c1ccc(C(F)(F)F)cc1Cl ZINC000443787262 567776130 /nfs/dbraw/zinc/77/61/30/567776130.db2.gz GGNNTTSEFCJEGH-LBPRGKRZSA-N 1 1 382.835 3.216 10 0 GGAEMO CCO[C@@H]1C[C@H](Nc2cc[nH+]c3ccc(Br)cc23)[C@@H]1n1cccn1 ZINC000555262127 567777402 /nfs/dbraw/zinc/77/74/02/567777402.db2.gz HHRIRQLBOQNCLT-KSZLIROESA-N 1 1 387.281 3.446 10 0 GGAEMO C[C@@H]([NH2+]CCCS(=O)(=O)c1ccc(Cl)cc1)c1cc2n(n1)CCCC2 ZINC000647305506 567778459 /nfs/dbraw/zinc/77/84/59/567778459.db2.gz SHTQNVCROUVRBP-CQSZACIVSA-N 1 1 381.929 3.387 10 0 GGAEMO CCOC(=O)CCC1CC[NH+](Cc2cc(OC)ncc2Br)CC1 ZINC000598596095 567778626 /nfs/dbraw/zinc/77/86/26/567778626.db2.gz HPHPWRSSVPGFQQ-UHFFFAOYSA-N 1 1 385.302 3.408 10 0 GGAEMO O[C@@H]1CC[N@@H+](Cc2ccc(CNc3ncc(Br)cc3F)cc2)C1 ZINC000624392776 567778741 /nfs/dbraw/zinc/77/87/41/567778741.db2.gz YZZXIMMSKNJKPI-OAHLLOKOSA-N 1 1 380.261 3.162 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)C(C)(C)c1ccc(Br)c(C)c1 ZINC000574443188 567779171 /nfs/dbraw/zinc/77/91/71/567779171.db2.gz ROAQFIHKOIEYGJ-INIZCTEOSA-N 1 1 397.357 3.262 10 0 GGAEMO Cc1[nH+]ccn1C[C@H](C)CNC(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21 ZINC000624423823 567779537 /nfs/dbraw/zinc/77/95/37/567779537.db2.gz VZOZAQDRSQADOI-OZTIQUGLSA-N 1 1 388.309 3.292 10 0 GGAEMO CCc1oc(C[NH2+][C@H](CO)c2cccc(Br)c2)cc1C(=O)OC ZINC000555334832 567779715 /nfs/dbraw/zinc/77/97/15/567779715.db2.gz IDIKHMZKCIGSIW-OAHLLOKOSA-N 1 1 382.254 3.214 10 0 GGAEMO C[N@H+]1CC[C@@H]2CN(C(=O)NCC/C=C/c3ccc(Br)cc3)C[C@@H]21 ZINC000624489103 567784460 /nfs/dbraw/zinc/78/44/60/567784460.db2.gz USXLBWNQYMQFRO-VOXDIGERSA-N 1 1 378.314 3.198 10 0 GGAEMO CS(=O)(=O)N1CCC[C@@H](C[N@H+]2CCC[C@H]2Cc2c(F)cccc2Cl)C1 ZINC000444060543 567787991 /nfs/dbraw/zinc/78/79/91/567787991.db2.gz VUPAWDGIMMFMJG-GJZGRUSLSA-N 1 1 388.936 3.158 10 0 GGAEMO CSc1ccccc1S(=O)(=O)N(C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000444082281 567790951 /nfs/dbraw/zinc/79/09/51/567790951.db2.gz HMNDGYOEWABTHK-KRWDZBQOSA-N 1 1 376.547 3.304 10 0 GGAEMO CS(=O)(=O)N1CC[C@@H](C[N@H+]2CCCCC[C@H]2Cc2ccccc2Cl)C1 ZINC000555613296 567790903 /nfs/dbraw/zinc/79/09/03/567790903.db2.gz UJJKDDOPQBHHCF-WMZOPIPTSA-N 1 1 384.973 3.409 10 0 GGAEMO CS(=O)(=O)N1CC[C@H](C[N@H+]2CCCCC[C@@H]2Cc2ccccc2Cl)C1 ZINC000555613295 567791356 /nfs/dbraw/zinc/79/13/56/567791356.db2.gz UJJKDDOPQBHHCF-SJLPKXTDSA-N 1 1 384.973 3.409 10 0 GGAEMO Cc1cn2c([nH+]1)C[C@H](c1nc(-c3cn4ccc(Br)cc4n3)no1)CC2 ZINC000624628597 567791674 /nfs/dbraw/zinc/79/16/74/567791674.db2.gz GBPNOXQMCLKWEG-LLVKDONJSA-N 1 1 399.252 3.382 10 0 GGAEMO O=C(c1cc(Cl)ccc1Br)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000647628484 567793845 /nfs/dbraw/zinc/79/38/45/567793845.db2.gz LLQPMVYQPGIFHY-UONOGXRCSA-N 1 1 375.669 3.361 10 0 GGAEMO O=C(c1cc(Cl)cc(F)c1Br)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000647631487 567794011 /nfs/dbraw/zinc/79/40/11/567794011.db2.gz IJCHKHMNQUMFKV-QWHCGFSZSA-N 1 1 393.659 3.500 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)c1cc(Cl)cc(Br)c1F ZINC000444168766 567795055 /nfs/dbraw/zinc/79/50/55/567795055.db2.gz JBCYNUDXSHAYMY-NSHDSACASA-N 1 1 393.684 3.082 10 0 GGAEMO Cc1c(C(=O)Nc2ccc(Cl)c(C[N@H+](C)CCO)c2)sc2nccn12 ZINC000647657464 567796208 /nfs/dbraw/zinc/79/62/08/567796208.db2.gz FDETXIPQUKYTIV-UHFFFAOYSA-N 1 1 378.885 3.034 10 0 GGAEMO Cc1c(C(=O)Nc2ccc(Cl)c(C[N@@H+](C)CCO)c2)sc2nccn12 ZINC000647657464 567796213 /nfs/dbraw/zinc/79/62/13/567796213.db2.gz FDETXIPQUKYTIV-UHFFFAOYSA-N 1 1 378.885 3.034 10 0 GGAEMO CC[C@@H](CO)[NH+]1CCN(C(=O)c2cc(Br)cc3ccccc32)CC1 ZINC000533980073 567796195 /nfs/dbraw/zinc/79/61/95/567796195.db2.gz OKYIUTISJNHOPG-INIZCTEOSA-N 1 1 391.309 3.131 10 0 GGAEMO C[N@H+](CCO)Cc1cc(NC(=O)c2csc(C(F)(F)F)n2)ccc1Cl ZINC000647657609 567796359 /nfs/dbraw/zinc/79/63/59/567796359.db2.gz LSUCYJOMKDOTEZ-UHFFFAOYSA-N 1 1 393.818 3.492 10 0 GGAEMO C[N@@H+](CCO)Cc1cc(NC(=O)c2csc(C(F)(F)F)n2)ccc1Cl ZINC000647657609 567796364 /nfs/dbraw/zinc/79/63/64/567796364.db2.gz LSUCYJOMKDOTEZ-UHFFFAOYSA-N 1 1 393.818 3.492 10 0 GGAEMO C[C@H](c1cccc(C(F)(F)F)c1)[N@@H+](C)C[C@@H]1CCCN(S(C)(=O)=O)C1 ZINC000444242728 567798883 /nfs/dbraw/zinc/79/88/83/567798883.db2.gz GRSAXMMYAXCBSE-KGLIPLIRSA-N 1 1 378.460 3.370 10 0 GGAEMO CCC[N@H+](Cc1c(F)cccc1Cl)C[C@@H]1CCCN(S(C)(=O)=O)C1 ZINC000444248263 567798939 /nfs/dbraw/zinc/79/89/39/567798939.db2.gz NDTHTTMUOGKMDQ-AWEZNQCLSA-N 1 1 376.925 3.363 10 0 GGAEMO CS(=O)(=O)N1CCC[C@H](C[N@@H+]2CCc3c(Cl)c(Cl)ccc3C2)C1 ZINC000444256619 567799006 /nfs/dbraw/zinc/79/90/06/567799006.db2.gz ADZSVCVQNFYRDY-GFCCVEGCSA-N 1 1 377.337 3.023 10 0 GGAEMO CS(=O)(=O)N1CCC[C@H](C[N@H+]2CCc3c(Cl)c(Cl)ccc3C2)C1 ZINC000444256619 567799007 /nfs/dbraw/zinc/79/90/07/567799007.db2.gz ADZSVCVQNFYRDY-GFCCVEGCSA-N 1 1 377.337 3.023 10 0 GGAEMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)N[C@H](CO)c1cccc(Cl)c1Cl ZINC000624788567 567800042 /nfs/dbraw/zinc/80/00/42/567800042.db2.gz WAUZAWDHZLROAY-XJKSGUPXSA-N 1 1 386.323 3.343 10 0 GGAEMO Brc1cncc(Br)c1C[NH2+][C@H]1CO[C@@H](C2CC2)C1 ZINC000668204554 567800080 /nfs/dbraw/zinc/80/00/80/567800080.db2.gz KHQYJNHPYROATP-NOZJJQNGSA-N 1 1 376.092 3.264 10 0 GGAEMO Cc1cccc2c1C[C@H]([NH2+]Cc1ncc(I)s1)CO2 ZINC000598986675 567801851 /nfs/dbraw/zinc/80/18/51/567801851.db2.gz KKGRQPISBNYEKI-JTQLQIEISA-N 1 1 386.258 3.149 10 0 GGAEMO C[N@H+]1CCC[C@H]1[C@H]1COCCN1C(=O)CSc1cc(Cl)ccc1Cl ZINC000647822536 567803244 /nfs/dbraw/zinc/80/32/44/567803244.db2.gz VGIMKJJDSOCESM-LSDHHAIUSA-N 1 1 389.348 3.407 10 0 GGAEMO C[N@H+]1CCC[C@H]1[C@H]1COCCN1C(=O)c1[nH]c2ccc(Cl)cc2c1Cl ZINC000647822078 567803319 /nfs/dbraw/zinc/80/33/19/567803319.db2.gz PXKLLSMZDSMQPA-LSDHHAIUSA-N 1 1 382.291 3.410 10 0 GGAEMO C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)N1CCOC[C@@H]1[C@H]1CCC[N@H+]1C ZINC000647823519 567803342 /nfs/dbraw/zinc/80/33/42/567803342.db2.gz JREKJTKDSZUAKX-FSPWUOQZSA-N 1 1 385.335 3.494 10 0 GGAEMO C[C@H]([NH2+][C@H]1CCN(C2CCC2)C1=O)c1ccccc1I ZINC000599092072 567805008 /nfs/dbraw/zinc/80/50/08/567805008.db2.gz DZLPIXPXQZJZQZ-NHYWBVRUSA-N 1 1 384.261 3.095 10 0 GGAEMO O=C(CCN1CCC[C@@H]([C@H]2CCC[NH2+]2)C1)Nc1ccccc1Br ZINC000647901615 567805601 /nfs/dbraw/zinc/80/56/01/567805601.db2.gz RPERTQDCSYWEQN-GDBMZVCRSA-N 1 1 380.330 3.242 10 0 GGAEMO Cc1noc([C@H]2OCC[C@H]2[NH2+][C@@H](C)c2ccccc2I)n1 ZINC000599093592 567805679 /nfs/dbraw/zinc/80/56/79/567805679.db2.gz RXNGMRQIDPFXEZ-FZZIBODNSA-N 1 1 399.232 3.163 10 0 GGAEMO O=C(CCN1CCC[C@H]([C@@H]2CCC[NH2+]2)C1)Nc1cccc(Br)c1 ZINC000647902909 567806244 /nfs/dbraw/zinc/80/62/44/567806244.db2.gz DJUGEOYUEUBYDV-YOEHRIQHSA-N 1 1 380.330 3.242 10 0 GGAEMO COc1ccc(Br)cc1C[NH2+][C@H](c1cnn(C)c1)C1(CO)CCC1 ZINC000647944914 567808379 /nfs/dbraw/zinc/80/83/79/567808379.db2.gz PKWWROOYKLZDFO-QGZVFWFLSA-N 1 1 394.313 3.185 10 0 GGAEMO C[C@H](Cc1cc(Br)ccc1F)NC(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000534379511 567808943 /nfs/dbraw/zinc/80/89/43/567808943.db2.gz CNPARHBWEMBSDO-MLGOLLRUSA-N 1 1 398.320 3.397 10 0 GGAEMO Cc1nn(C)c(NC(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c1Br ZINC000647984305 567809065 /nfs/dbraw/zinc/80/90/65/567809065.db2.gz PTDDHLWSBLVGIY-ZFWWWQNUSA-N 1 1 392.301 3.058 10 0 GGAEMO CN(C)C(=O)C1CC[NH+](Cc2cc(OC(F)F)ccc2Br)CC1 ZINC000647999581 567809914 /nfs/dbraw/zinc/80/99/14/567809914.db2.gz QFNJGJPFMUWFHM-UHFFFAOYSA-N 1 1 391.256 3.351 10 0 GGAEMO C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1cc(OC(F)F)ccc1Br ZINC000648002412 567810415 /nfs/dbraw/zinc/81/04/15/567810415.db2.gz UUAJGIREIGUCMG-ZJUUUORDSA-N 1 1 377.229 3.136 10 0 GGAEMO C[N@H+]1CCC[C@@H](CNC(=O)c2cc(Br)cc(N3CCCC3)c2)C1 ZINC000668463480 567810455 /nfs/dbraw/zinc/81/04/55/567810455.db2.gz QZZMIRCUEPCGAA-AWEZNQCLSA-N 1 1 380.330 3.121 10 0 GGAEMO C[C@@]1(c2ccccc2)CC[C@@H]([N@H+]2C[C@H](C(F)(F)F)[C@@H](S(C)(=O)=O)C2)C1 ZINC000668469869 567810952 /nfs/dbraw/zinc/81/09/52/567810952.db2.gz MMTFVFYVRRZCNA-LTIDMASMSA-N 1 1 375.456 3.404 10 0 GGAEMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1cc(Br)cc(N2CCCC2)c1 ZINC000668457733 567810992 /nfs/dbraw/zinc/81/09/92/567810992.db2.gz ODACURWDWRUMJN-KRWDZBQOSA-N 1 1 392.341 3.263 10 0 GGAEMO Cc1cc(=O)n2nc(C[N@H+](C)Cc3ccc(Br)cc3C)sc2n1 ZINC000444693692 567811081 /nfs/dbraw/zinc/81/10/81/567811081.db2.gz OVOSOMJQBDHMIJ-UHFFFAOYSA-N 1 1 393.310 3.162 10 0 GGAEMO C[N@H+](CCC(F)(F)F)[C@H](CNC(=O)C(C)(C)CO)c1ccc(Cl)cc1 ZINC000575071479 567811342 /nfs/dbraw/zinc/81/13/42/567811342.db2.gz ZPOMIFBZGWOEMR-CQSZACIVSA-N 1 1 380.838 3.400 10 0 GGAEMO C[N@@H+](CCC(F)(F)F)[C@H](CNC(=O)C(C)(C)CO)c1ccc(Cl)cc1 ZINC000575071479 567811344 /nfs/dbraw/zinc/81/13/44/567811344.db2.gz ZPOMIFBZGWOEMR-CQSZACIVSA-N 1 1 380.838 3.400 10 0 GGAEMO Cc1cc(Br)ccc1C[N@H+](C)[C@H]1CCCN(c2ccn(C)n2)C1=O ZINC000444710110 567811523 /nfs/dbraw/zinc/81/15/23/567811523.db2.gz TVJKMHVGAWOASK-INIZCTEOSA-N 1 1 391.313 3.118 10 0 GGAEMO CC[N@H+]1CCCN(C(=O)c2cc(Br)cc(N3CCCC3)c2)CC1 ZINC000668474061 567811608 /nfs/dbraw/zinc/81/16/08/567811608.db2.gz MKZXYFVZNZTUKS-UHFFFAOYSA-N 1 1 380.330 3.217 10 0 GGAEMO Cc1sc2nc(C)nc(SCC(=O)N3[C@@H](C)C[NH+](C)C[C@@H]3C)c2c1C ZINC000534433806 567811661 /nfs/dbraw/zinc/81/16/61/567811661.db2.gz YHSUZDRGSVYAMH-QWRGUYRKSA-N 1 1 378.567 3.260 10 0 GGAEMO O[C@H](COc1ccc(Br)cc1)C[N@H+]1CC[C@H](CC(F)(F)F)C1 ZINC000444713760 567812278 /nfs/dbraw/zinc/81/22/78/567812278.db2.gz ZRGDVVZPXKRTIV-YPMHNXCESA-N 1 1 382.220 3.463 10 0 GGAEMO Cn1ncc(Br)c1C[NH2+][C@H](c1ccccc1)C1(CO)CC=CC1 ZINC000648068941 567812584 /nfs/dbraw/zinc/81/25/84/567812584.db2.gz IZPZKGRBHDYKTI-QGZVFWFLSA-N 1 1 376.298 3.342 10 0 GGAEMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1ccc(I)c(Cl)c1 ZINC000534490924 567812658 /nfs/dbraw/zinc/81/26/58/567812658.db2.gz WSZLNVZZGNGTNY-AOOOYVTPSA-N 1 1 392.668 3.109 10 0 GGAEMO O=C(NCCc1ccc(Cl)cc1Cl)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000668545944 567813005 /nfs/dbraw/zinc/81/30/05/567813005.db2.gz CBENNTNYPGRERB-KRWDZBQOSA-N 1 1 379.291 3.287 10 0 GGAEMO C[N@H+](Cc1cnc(-c2ccc(Br)cc2)s1)C[C@H]1COCCO1 ZINC000668544816 567813192 /nfs/dbraw/zinc/81/31/92/567813192.db2.gz HWNMMTKCZGRQBA-AWEZNQCLSA-N 1 1 383.311 3.420 10 0 GGAEMO CNC(=O)[C@]1(C(F)(F)F)CC[N@H+](Cc2cccc(F)c2Br)C1 ZINC000648072919 567813390 /nfs/dbraw/zinc/81/33/90/567813390.db2.gz VTVPLXURVPUZIW-ZDUSSCGKSA-N 1 1 383.183 3.089 10 0 GGAEMO CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2cccc(F)c2Br)C1 ZINC000648072919 567813393 /nfs/dbraw/zinc/81/33/93/567813393.db2.gz VTVPLXURVPUZIW-ZDUSSCGKSA-N 1 1 383.183 3.089 10 0 GGAEMO CCOCCOc1ccc(Br)cc1C[NH+]1C[C@@H](C)C(O)[C@H](C)C1 ZINC000668554148 567813777 /nfs/dbraw/zinc/81/37/77/567813777.db2.gz KMCJMRAXYWRVAN-ZIAGYGMSSA-N 1 1 386.330 3.313 10 0 GGAEMO CCOCCOc1ccc(Br)cc1C[N@H+]1C[C@@H]2COC[C@]2(C)C1 ZINC000668594844 567814333 /nfs/dbraw/zinc/81/43/33/567814333.db2.gz HRHVLDUXCFVOAU-QAPCUYQASA-N 1 1 384.314 3.333 10 0 GGAEMO CCOCCOc1ccc(Br)cc1C[N@H+]1C[C@@H]2COC[C@@]2(C)C1 ZINC000668594842 567814380 /nfs/dbraw/zinc/81/43/80/567814380.db2.gz HRHVLDUXCFVOAU-CRAIPNDOSA-N 1 1 384.314 3.333 10 0 GGAEMO CN(C(=O)c1cc(Br)cc(N2CCCC2)c1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000668599004 567814640 /nfs/dbraw/zinc/81/46/40/567814640.db2.gz QMBHMAGNAPLXOH-QGZVFWFLSA-N 1 1 392.341 3.358 10 0 GGAEMO CN(C(=O)c1cc(Br)cc(N2CCCC2)c1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000668599003 567814794 /nfs/dbraw/zinc/81/47/94/567814794.db2.gz QMBHMAGNAPLXOH-KRWDZBQOSA-N 1 1 392.341 3.358 10 0 GGAEMO CN(C(=O)c1cc(-c2ccc(Br)cc2)no1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000668598170 567814855 /nfs/dbraw/zinc/81/48/55/567814855.db2.gz IXVMGGLEBLAMOT-HNNXBMFYSA-N 1 1 390.281 3.413 10 0 GGAEMO COc1ccc(S(=O)(=O)N[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)cc1Cl ZINC000534637213 567815405 /nfs/dbraw/zinc/81/54/05/567815405.db2.gz CHMINNIHSJAVEA-WMZOPIPTSA-N 1 1 380.897 3.072 10 0 GGAEMO COc1ccc(S(=O)(=O)N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)cc1Cl ZINC000534637213 567815408 /nfs/dbraw/zinc/81/54/08/567815408.db2.gz CHMINNIHSJAVEA-WMZOPIPTSA-N 1 1 380.897 3.072 10 0 GGAEMO C[N@@H+](CCNC(=O)[C@H]1COc2ccc(Br)cc21)C1CCCCC1 ZINC000534642737 567815757 /nfs/dbraw/zinc/81/57/57/567815757.db2.gz WMFWWXPEJVLHPU-INIZCTEOSA-N 1 1 381.314 3.306 10 0 GGAEMO CC(C)Oc1cccc(C[NH+]2CCN(Cc3nnc4n3CCCCC4)CC2)c1 ZINC000048264612 570225300 /nfs/dbraw/zinc/22/53/00/570225300.db2.gz DZULIVMYKDDFTR-UHFFFAOYSA-N 1 1 383.540 3.110 10 0 GGAEMO Cc1[nH]c2ccc(C(=O)NCc3ccc(N4CCC[N@H+](C)CC4)nc3)cc2c1C ZINC000048288405 570227984 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3.179 10 0 GGAEMO C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)[N@@H+](C)CC(=O)N1CCO[C@H](C)C1 ZINC000011344939 221114592 /nfs/dbraw/zinc/11/45/92/221114592.db2.gz PSJSCYGFLQWQMV-MSOLQXFVSA-N 1 1 395.503 3.179 10 0 GGAEMO CCN(C(=O)C[NH+]1CCC(C(=O)NCc2ccccc2)CC1)c1ccccc1C ZINC000011469472 221115683 /nfs/dbraw/zinc/11/56/83/221115683.db2.gz GQZIKNCVEADPMD-UHFFFAOYSA-N 1 1 393.531 3.376 10 0 GGAEMO COc1ccc(F)c(CN2CCC[C@@]3(CC[N@@H+](Cc4cccnc4)C3)C2=O)c1 ZINC000011937370 221138537 /nfs/dbraw/zinc/13/85/37/221138537.db2.gz LEDJJNXXFIOLQB-QFIPXVFZSA-N 1 1 383.467 3.244 10 0 GGAEMO c1ccc(CN2CCC([N@H+]3CCC[C@@H](Nc4ccc5c(c4)OCO5)C3)CC2)nc1 ZINC000011938554 221141014 /nfs/dbraw/zinc/14/10/14/221141014.db2.gz XWQFKYJEYHPBLK-HXUWFJFHSA-N 1 1 394.519 3.351 10 0 GGAEMO CN1CCCN(C(=O)[C@@H]2CC23CC[NH+](CC2=CC[C@H]4C[C@@H]2C4(C)C)CC3)CC1 ZINC000012154916 221160774 /nfs/dbraw/zinc/16/07/74/221160774.db2.gz YLQFJIKUFTUGAG-ACRUOGEOSA-N 1 1 385.596 3.245 10 0 GGAEMO COCc1ccc([C@@H]2C[C@H]3CN(Cc4ccc(OC)cc4)C(=O)[C@]34CCC[N@@H+]24)o1 ZINC000012027201 221142931 /nfs/dbraw/zinc/14/29/31/221142931.db2.gz DDKKGFBXMYFOBN-NYDSKATKSA-N 1 1 396.487 3.373 10 0 GGAEMO COc1ccc(CC[N@@H+](C)[C@@H]2CCCN(C(=O)NC(C)(C)C)C2)cc1OC ZINC000012050815 221144952 /nfs/dbraw/zinc/14/49/52/221144952.db2.gz RGLZNFGEIDPESY-QGZVFWFLSA-N 1 1 377.529 3.151 10 0 GGAEMO COc1ccc(F)c(CN2CCC[C@]3(CC[N@@H+](Cc4ccccn4)C3)C2=O)c1 ZINC000012441068 221195149 /nfs/dbraw/zinc/19/51/49/221195149.db2.gz UJFWSCYMBVRWQA-JOCHJYFZSA-N 1 1 383.467 3.244 10 0 GGAEMO COc1ccc(F)c(CN2CCC[C@@]3(CC[N@@H+](Cc4ccccn4)C3)C2=O)c1 ZINC000012441066 221195600 /nfs/dbraw/zinc/19/56/00/221195600.db2.gz UJFWSCYMBVRWQA-QFIPXVFZSA-N 1 1 383.467 3.244 10 0 GGAEMO Cc1cnc(CNCc2ccccc2OC[C@H](O)C[N@H+](C)C2CCCCC2)cn1 ZINC000012576986 221208078 /nfs/dbraw/zinc/20/80/78/221208078.db2.gz VYIBCDUHBINQKN-JOCHJYFZSA-N 1 1 398.551 3.079 10 0 GGAEMO O=C(c1ccc(N[C@@H]2CCSC2)nc1)N1CCC[N@H+](C2CCCCC2)CC1 ZINC000012757182 221227046 /nfs/dbraw/zinc/22/70/46/221227046.db2.gz DFRCPJUVDVDPHF-GOSISDBHSA-N 1 1 388.581 3.480 10 0 GGAEMO C[C@H](NCc1ccccc1C[NH+]1CCCC1)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000012771738 221229073 /nfs/dbraw/zinc/22/90/73/221229073.db2.gz JHXREFIVFPATDJ-KRWDZBQOSA-N 1 1 395.503 3.170 10 0 GGAEMO Cc1cc(Cl)ccc1OCC(=O)NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000012773049 221229168 /nfs/dbraw/zinc/22/91/68/221229168.db2.gz JFXNDIZIQHSHES-UHFFFAOYSA-N 1 1 388.895 3.176 10 0 GGAEMO O=C(Nc1ccccc1)[C@H]1CCC[N@H+](Cc2cc(=O)oc3cc(O)ccc23)C1 ZINC000012777349 221230318 /nfs/dbraw/zinc/23/03/18/221230318.db2.gz MWTTZDAKYPVJHN-HNNXBMFYSA-N 1 1 378.428 3.349 10 0 GGAEMO COc1ccc([C@H]2CCCCC[N@H+]2CC(=O)Nc2ccc(C(N)=O)cc2)cc1 ZINC000012879463 221241657 /nfs/dbraw/zinc/24/16/57/221241657.db2.gz RHYRMHDYLGNLKD-HXUWFJFHSA-N 1 1 381.476 3.350 10 0 GGAEMO C[C@@H](NC(=O)CC[NH+]1CCN(C(=O)c2ccccc2Cl)CC1)c1ccccc1 ZINC000012934748 221248075 /nfs/dbraw/zinc/24/80/75/221248075.db2.gz VGHGYXRRIDPVID-QGZVFWFLSA-N 1 1 399.922 3.365 10 0 GGAEMO C[N@@H+]1CCN(C(=O)/C=C/c2ccc(N3CCCC3=O)cc2)[C@H](c2ccccc2)C1 ZINC000012972526 221251485 /nfs/dbraw/zinc/25/14/85/221251485.db2.gz JHRNUKJMYRZQNI-FZNBYNMYSA-N 1 1 389.499 3.342 10 0 GGAEMO C[N@H+]1CCN(C(=O)/C=C/c2ccc(N3CCCC3=O)cc2)[C@H](c2ccccc2)C1 ZINC000012972526 221251487 /nfs/dbraw/zinc/25/14/87/221251487.db2.gz JHRNUKJMYRZQNI-FZNBYNMYSA-N 1 1 389.499 3.342 10 0 GGAEMO COc1ccc([C@@H]2CCC[N@@H+]2CC(=O)Nc2ccc3c(c2)CCN3C(C)=O)cc1 ZINC000012981024 221252400 /nfs/dbraw/zinc/25/24/00/221252400.db2.gz JMDTWYPNSYSMBW-NRFANRHFSA-N 1 1 393.487 3.380 10 0 GGAEMO COc1ccc([C@@H]2CCC[N@H+]2CC(=O)Nc2ccc3c(c2)CCN3C(C)=O)cc1 ZINC000012981024 221252402 /nfs/dbraw/zinc/25/24/02/221252402.db2.gz JMDTWYPNSYSMBW-NRFANRHFSA-N 1 1 393.487 3.380 10 0 GGAEMO O=C(C[N@H+]1CCCN(c2ccc(C(F)(F)F)cn2)CC1)Nc1ccccc1 ZINC000012920430 221245598 /nfs/dbraw/zinc/24/55/98/221245598.db2.gz ZNRPZVJXUQIMRX-UHFFFAOYSA-N 1 1 378.398 3.251 10 0 GGAEMO O=C(C[N@@H+]1CCCN(c2ccc(C(F)(F)F)cn2)CC1)Nc1ccccc1 ZINC000012920430 221245601 /nfs/dbraw/zinc/24/56/01/221245601.db2.gz ZNRPZVJXUQIMRX-UHFFFAOYSA-N 1 1 378.398 3.251 10 0 GGAEMO Cc1ccc(C)n1CC[NH+]1CCN(C(=O)c2cc(-c3ccc(C)cc3)n[nH]2)CC1 ZINC000013366592 221267050 /nfs/dbraw/zinc/26/70/50/221267050.db2.gz NDHGQYSVVHYLOR-UHFFFAOYSA-N 1 1 391.519 3.261 10 0 GGAEMO c1ccc2c(c1)C=C(C[N@H+](CCCN1CCOCC1)Cc1cccnc1)CO2 ZINC000013569053 221274991 /nfs/dbraw/zinc/27/49/91/221274991.db2.gz VALDOBOWDNJXPC-UHFFFAOYSA-N 1 1 379.504 3.082 10 0 GGAEMO OCC[NH2+]CCCNCc1ccc(OCc2ccccc2)c(Br)c1 ZINC000013733307 221285079 /nfs/dbraw/zinc/28/50/79/221285079.db2.gz CWEYPKUJAOLMTO-UHFFFAOYSA-N 1 1 393.325 3.090 10 0 GGAEMO Cc1sc2nc(C)nc(N3CCC[N@H+](CC(=O)NC(C)(C)C)CC3)c2c1C ZINC000014124040 221299355 /nfs/dbraw/zinc/29/93/55/221299355.db2.gz OTTVVDZLVSHLBF-UHFFFAOYSA-N 1 1 389.569 3.043 10 0 GGAEMO Cc1sc2nc(C)nc(N3CCC[N@@H+](CC(=O)NC(C)(C)C)CC3)c2c1C ZINC000014124040 221299357 /nfs/dbraw/zinc/29/93/57/221299357.db2.gz OTTVVDZLVSHLBF-UHFFFAOYSA-N 1 1 389.569 3.043 10 0 GGAEMO O=C(C[NH2+][C@@H](c1cccs1)c1ccccc1)N1CC(=O)Nc2ccccc21 ZINC000014141753 221301335 /nfs/dbraw/zinc/30/13/35/221301335.db2.gz BKPBSIKOICFIKE-OAQYLSRUSA-N 1 1 377.469 3.412 10 0 GGAEMO O[C@@H](COCCOc1ccc(Cl)cc1)C[N@H+]1CCC[C@@H](C(F)(F)F)C1 ZINC000014200852 221303296 /nfs/dbraw/zinc/30/32/96/221303296.db2.gz UEVFWOBSABNDMR-UKRRQHHQSA-N 1 1 381.822 3.371 10 0 GGAEMO CC(C)CN1C[C@H](OCc2ccccn2)C[N@H+](CCc2ccccc2)CC1=O ZINC000014542278 221312347 /nfs/dbraw/zinc/31/23/47/221312347.db2.gz FDQUKRJDZVJOHK-JOCHJYFZSA-N 1 1 381.520 3.010 10 0 GGAEMO CC(C)CN1C[C@H](OCc2ccccn2)C[N@@H+](CCc2ccccc2)CC1=O ZINC000014542278 221312348 /nfs/dbraw/zinc/31/23/48/221312348.db2.gz FDQUKRJDZVJOHK-JOCHJYFZSA-N 1 1 381.520 3.010 10 0 GGAEMO COc1ccc([C@H]2CCC[N@@H+]2C[C@@H](O)COc2ccc(C(C)=O)cc2)c(OC)c1 ZINC000014200953 221304704 /nfs/dbraw/zinc/30/47/04/221304704.db2.gz DLJXCYRZVGAWOD-XMSQKQJNSA-N 1 1 399.487 3.483 10 0 GGAEMO COc1ccc([C@H]2CCC[N@H+]2C[C@@H](O)COc2ccc(C(C)=O)cc2)c(OC)c1 ZINC000014200953 221304707 /nfs/dbraw/zinc/30/47/07/221304707.db2.gz DLJXCYRZVGAWOD-XMSQKQJNSA-N 1 1 399.487 3.483 10 0 GGAEMO C[C@H](C(=O)NCc1ccc2c(c1)OCO2)[N@H+](C)CCOc1ccc(Cl)cc1 ZINC000014241363 221305874 /nfs/dbraw/zinc/30/58/74/221305874.db2.gz HWGVQSHMHYARTR-CQSZACIVSA-N 1 1 390.867 3.084 10 0 GGAEMO C[C@H](C(=O)NCc1ccc2c(c1)OCO2)[N@@H+](C)CCOc1ccc(Cl)cc1 ZINC000014241363 221305878 /nfs/dbraw/zinc/30/58/78/221305878.db2.gz HWGVQSHMHYARTR-CQSZACIVSA-N 1 1 390.867 3.084 10 0 GGAEMO CCOC(=O)c1ccc(OC[C@H](O)C[N@@H+](C)[C@@H](C)c2ccc(F)cc2)cc1 ZINC000014242194 221307456 /nfs/dbraw/zinc/30/74/56/221307456.db2.gz TUVLYSBOWWNEJR-HNAYVOBHSA-N 1 1 375.440 3.435 10 0 GGAEMO CC[NH+]1CCN(C(=O)c2nc(-c3ccccc3)n(-c3cccc(C)c3)n2)CC1 ZINC000014609596 221313270 /nfs/dbraw/zinc/31/32/70/221313270.db2.gz VLHQEXUWFUGDLB-UHFFFAOYSA-N 1 1 375.476 3.020 10 0 GGAEMO COc1ccc(NC(C)=O)cc1NC(=O)C[N@H+](C)Cc1ccc(SC)cc1 ZINC000015480961 221336086 /nfs/dbraw/zinc/33/60/86/221336086.db2.gz KORVVUJOTYHUHJ-UHFFFAOYSA-N 1 1 387.505 3.446 10 0 GGAEMO COc1ccc(NC(C)=O)cc1NC(=O)C[N@@H+](C)Cc1ccc(SC)cc1 ZINC000015480961 221336089 /nfs/dbraw/zinc/33/60/89/221336089.db2.gz KORVVUJOTYHUHJ-UHFFFAOYSA-N 1 1 387.505 3.446 10 0 GGAEMO COCCc1ncc(CN2CC[C@@]3(C2)CCC[N@@H+](Cc2ccccc2F)C3)cn1 ZINC000015069889 221329451 /nfs/dbraw/zinc/32/94/51/221329451.db2.gz ABZOKCJQCQKUQF-QHCPKHFHSA-N 1 1 398.526 3.293 10 0 GGAEMO COCCc1ncc(C[N@@H+]2CC[C@@]3(C2)CCCN(Cc2ccccc2F)C3)cn1 ZINC000015069889 221329454 /nfs/dbraw/zinc/32/94/54/221329454.db2.gz ABZOKCJQCQKUQF-QHCPKHFHSA-N 1 1 398.526 3.293 10 0 GGAEMO COCCc1ncc(C[N@H+]2CC[C@@]3(C2)CCCN(Cc2ccccc2F)C3)cn1 ZINC000015069889 221329455 /nfs/dbraw/zinc/32/94/55/221329455.db2.gz ABZOKCJQCQKUQF-QHCPKHFHSA-N 1 1 398.526 3.293 10 0 GGAEMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2nn(C)c3c2COc2ccccc2-3)C1 ZINC000015674184 221338608 /nfs/dbraw/zinc/33/86/08/221338608.db2.gz AUEDPKFEEZLLFV-IYBDPMFKSA-N 1 1 382.508 3.077 10 0 GGAEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCCNC(=O)c1nn(C)c2c1COc1ccccc1-2 ZINC000015674370 221338929 /nfs/dbraw/zinc/33/89/29/221338929.db2.gz LCEMFSLTHNRQPU-IYBDPMFKSA-N 1 1 382.508 3.362 10 0 GGAEMO CC[NH+]1CCN(C(=O)c2cc(C)nc3c2c(C)nn3-c2ccc(C)cc2)CC1 ZINC000015678472 221339901 /nfs/dbraw/zinc/33/99/01/221339901.db2.gz RUXUFXQGPJWKLQ-UHFFFAOYSA-N 1 1 377.492 3.123 10 0 GGAEMO Cn1cc(NC(=O)NCCC[N@H+]2CCc3ccccc3C2)c2ccccc2c1=O ZINC000015680509 221340224 /nfs/dbraw/zinc/34/02/24/221340224.db2.gz HNVBCISPNCDXAG-UHFFFAOYSA-N 1 1 390.487 3.108 10 0 GGAEMO c1ccc(CC[N@H+]2CCc3nc(N4CCN(c5ccccc5)CC4)ncc3C2)cc1 ZINC000015779501 221344984 /nfs/dbraw/zinc/34/49/84/221344984.db2.gz HJJPPJAEZVHBHI-UHFFFAOYSA-N 1 1 399.542 3.404 10 0 GGAEMO COc1ccc([C@@H]2CCC[N@@H+]2Cc2cc(=O)n3ccc(C)cc3n2)c(OC)c1 ZINC000016382274 221361452 /nfs/dbraw/zinc/36/14/52/221361452.db2.gz NHVGSTSYVQDNNU-IBGZPJMESA-N 1 1 379.460 3.357 10 0 GGAEMO COc1ccc([C@@H]2CCC[N@H+]2Cc2cc(=O)n3ccc(C)cc3n2)c(OC)c1 ZINC000016382274 221361456 /nfs/dbraw/zinc/36/14/56/221361456.db2.gz NHVGSTSYVQDNNU-IBGZPJMESA-N 1 1 379.460 3.357 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ZINC000121810901 564387427 /nfs/dbraw/zinc/38/74/27/564387427.db2.gz WGRPACUASKMQDQ-CABCVRRESA-N 1 1 383.330 3.027 10 0 GGAEMO COCc1c(Br)cccc1NC(=O)N[C@H]1C[N@H+](C(C)C)C[C@H]1C ZINC000121892452 564391199 /nfs/dbraw/zinc/39/11/99/564391199.db2.gz VEJLCQYCBBJVGM-WBMJQRKESA-N 1 1 384.318 3.446 10 0 GGAEMO C[C@@H](CNC(=O)[C@@H]1Cc2cc(Cl)ccc2O1)[N@@H+]1CCc2sccc2C1 ZINC000031962793 564394787 /nfs/dbraw/zinc/39/47/87/564394787.db2.gz CITRKPOTERAMQQ-SJCJKPOMSA-N 1 1 376.909 3.268 10 0 GGAEMO C[C@@H](CNC(=O)[C@@H]1Cc2cc(Cl)ccc2O1)[N@H+]1CCc2sccc2C1 ZINC000031962793 564394791 /nfs/dbraw/zinc/39/47/91/564394791.db2.gz CITRKPOTERAMQQ-SJCJKPOMSA-N 1 1 376.909 3.268 10 0 GGAEMO C[C@H]1CCC[N@@H+](CCCCNS(=O)(=O)c2cccc(C(F)(F)F)c2)C1 ZINC000032929527 564407721 /nfs/dbraw/zinc/40/77/21/564407721.db2.gz DJACXXVLIUNQNU-AWEZNQCLSA-N 1 1 378.460 3.496 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(OC)c(Br)c(OC)c2)[C@H](C)C1 ZINC000122344355 564409679 /nfs/dbraw/zinc/40/96/79/564409679.db2.gz QMKFTFYCNXLWQG-OCCSQVGLSA-N 1 1 399.329 3.269 10 0 GGAEMO COc1ccc(Br)c(C[NH+]2CCC(C(=O)N3CCCC3)CC2)c1 ZINC000122474931 564415760 /nfs/dbraw/zinc/41/57/60/564415760.db2.gz FVQCHMUMLKOOBN-UHFFFAOYSA-N 1 1 381.314 3.292 10 0 GGAEMO Clc1ccc(Br)c(CCNc2cc[nH+]c(N3CCOCC3)n2)c1 ZINC000545345281 564417783 /nfs/dbraw/zinc/41/77/83/564417783.db2.gz YTEHGZUSGQAGOK-UHFFFAOYSA-N 1 1 397.704 3.384 10 0 GGAEMO Cc1ccc(O[C@H](C)C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c(Br)c1 ZINC000122746880 564425676 /nfs/dbraw/zinc/42/56/76/564425676.db2.gz KRJPFIPKBWKIBN-RBSFLKMASA-N 1 1 383.330 3.466 10 0 GGAEMO COc1c(Br)cc(Br)cc1CN[C@@H]1CCC[N@H+](C)C1 ZINC000040672894 564428353 /nfs/dbraw/zinc/42/83/53/564428353.db2.gz NFQYRXCUPJEGDI-GFCCVEGCSA-N 1 1 392.135 3.404 10 0 GGAEMO COc1c(Br)cc(Br)cc1CN[C@@H]1CCC[N@@H+](C)C1 ZINC000040672894 564428354 /nfs/dbraw/zinc/42/83/54/564428354.db2.gz NFQYRXCUPJEGDI-GFCCVEGCSA-N 1 1 392.135 3.404 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)C(=O)c2cnn(-c3cccc(Br)c3)c2)CC[N@H+]1C ZINC000122972997 564434239 /nfs/dbraw/zinc/43/42/39/564434239.db2.gz SHXSRTMPHAQZGU-CJNGLKHVSA-N 1 1 391.313 3.190 10 0 GGAEMO Cc1ccc(I)c(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c1 ZINC000122999949 564435149 /nfs/dbraw/zinc/43/51/49/564435149.db2.gz VEILBPBZOMXOOZ-OLZOCXBDSA-N 1 1 386.277 3.154 10 0 GGAEMO C[C@@H]([NH2+][C@@H](C)c1ccc(Br)cc1Br)C(=O)N(C)C ZINC000041641983 564435963 /nfs/dbraw/zinc/43/59/63/564435963.db2.gz RFIVGCXVQSLNSD-DTWKUNHWSA-N 1 1 378.108 3.339 10 0 GGAEMO C[C@@H]1C[C@H](N(C)C(=O)c2cnn(-c3ccc(Br)cc3)c2)CC[N@H+]1C ZINC000123033567 564436150 /nfs/dbraw/zinc/43/61/50/564436150.db2.gz YGJFZZMXPPDKJN-CXAGYDPISA-N 1 1 391.313 3.190 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)C(=O)c2cnn(-c3ccc(Br)cc3)c2)CC[N@H+]1C ZINC000123034058 564436214 /nfs/dbraw/zinc/43/62/14/564436214.db2.gz YGJFZZMXPPDKJN-DYVFJYSZSA-N 1 1 391.313 3.190 10 0 GGAEMO C[C@H]1C[C@H](N(C)C(=O)c2cnn(-c3ccc(Br)cc3)c2)CC[N@H+]1C ZINC000123033799 564436254 /nfs/dbraw/zinc/43/62/54/564436254.db2.gz YGJFZZMXPPDKJN-SUMWQHHRSA-N 1 1 391.313 3.190 10 0 GGAEMO C[C@H]1C[C@@H](N(C)Cc2nnc(-c3ccccc3Br)o2)CC[N@H+]1C ZINC000123037610 564436549 /nfs/dbraw/zinc/43/65/49/564436549.db2.gz GEYUFFKXEGDPOV-STQMWFEESA-N 1 1 379.302 3.414 10 0 GGAEMO C[C@H]1C[C@H](N(C)Cc2nnc(-c3ccccc3Br)o2)CC[N@H+]1C ZINC000123037176 564436639 /nfs/dbraw/zinc/43/66/39/564436639.db2.gz GEYUFFKXEGDPOV-QWHCGFSZSA-N 1 1 379.302 3.414 10 0 GGAEMO C[C@@H]1C[C@H](N(C)Cc2nc(-c3cccc(Br)c3)no2)CC[N@H+]1C ZINC000123224448 564442180 /nfs/dbraw/zinc/44/21/80/564442180.db2.gz VWRPDPOCSYGJAQ-IUODEOHRSA-N 1 1 379.302 3.414 10 0 GGAEMO COC(=O)[C@@H]1CCC[N@H+](Cc2nc(-c3ccc(Br)cc3)c[nH]2)C1 ZINC000123238924 564443364 /nfs/dbraw/zinc/44/33/64/564443364.db2.gz BCEUCOYPWBWUNT-CYBMUJFWSA-N 1 1 378.270 3.224 10 0 GGAEMO COC(=O)[C@@H]1CCC[N@@H+](Cc2nc(-c3ccc(Br)cc3)c[nH]2)C1 ZINC000123238924 564443365 /nfs/dbraw/zinc/44/33/65/564443365.db2.gz BCEUCOYPWBWUNT-CYBMUJFWSA-N 1 1 378.270 3.224 10 0 GGAEMO C[C@H]1C[C@H](N(C)CCS(=O)(=O)c2cc(Cl)ccc2Cl)CC[N@H+]1C ZINC000123440429 564448410 /nfs/dbraw/zinc/44/84/10/564448410.db2.gz OPHMSWANQMJLNS-GXTWGEPZSA-N 1 1 379.353 3.182 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)CC(=O)Nc2ccc(Br)cc2Cl)CC[N@H+]1C ZINC000123481688 564449346 /nfs/dbraw/zinc/44/93/46/564449346.db2.gz ZBVWWEMZTXYSHR-YPMHNXCESA-N 1 1 388.737 3.456 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)CC(=O)Nc2ccc(OC(F)F)c(Cl)c2)CC[N@H+]1C ZINC000123815899 564462037 /nfs/dbraw/zinc/46/20/37/564462037.db2.gz JJKFQDDPQHSSMA-YPMHNXCESA-N 1 1 375.847 3.294 10 0 GGAEMO C[C@H]1C[C@H](N(C)CC(=O)Nc2ccc(OC(F)F)c(Cl)c2)CC[N@H+]1C ZINC000123815681 564462665 /nfs/dbraw/zinc/46/26/65/564462665.db2.gz JJKFQDDPQHSSMA-WCQYABFASA-N 1 1 375.847 3.294 10 0 GGAEMO C[C@@H]1C[C@H]([N@@H+](C)CCC(=O)Nc2ccc(Br)cc2F)CCN1C ZINC000123855277 564463355 /nfs/dbraw/zinc/46/33/55/564463355.db2.gz FHYIVOMQUNBRJC-TZMCWYRMSA-N 1 1 386.309 3.331 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(-n3cc(Br)cn3)cc2)CC[N@H+]1C ZINC000123847785 564463465 /nfs/dbraw/zinc/46/34/65/564463465.db2.gz FHBVTSMQCDDYRE-DYVFJYSZSA-N 1 1 391.313 3.190 10 0 GGAEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1c(F)cccc1I ZINC000123945864 564466628 /nfs/dbraw/zinc/46/66/28/564466628.db2.gz WOZPZQILSNAOKT-NSHDSACASA-N 1 1 390.240 3.035 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)Cc2nc(Cc3cccc(Br)c3)no2)CC[N@H+]1C ZINC000123926320 564466767 /nfs/dbraw/zinc/46/67/67/564466767.db2.gz PGYJCQMNXFKTIR-CJNGLKHVSA-N 1 1 393.329 3.337 10 0 GGAEMO C[C@H](NC(=O)CN(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1)c1ccc(Br)cc1 ZINC000123966668 564467854 /nfs/dbraw/zinc/46/78/54/564467854.db2.gz LRRCCWKAEWQCCJ-JKIFEVAISA-N 1 1 382.346 3.041 10 0 GGAEMO O=C(CCc1ccc(Cl)s1)NCc1ccc(C[NH+]2CCOCC2)cc1 ZINC000044349674 564468177 /nfs/dbraw/zinc/46/81/77/564468177.db2.gz LPEVNCNZQJQNJH-UHFFFAOYSA-N 1 1 378.925 3.483 10 0 GGAEMO C[C@H]1C[C@@H](N(C)C(=O)c2ccn(-c3cccc(Br)c3)n2)CC[N@H+]1C ZINC000124029904 564469182 /nfs/dbraw/zinc/46/91/82/564469182.db2.gz BHXBCEWBQVUHRA-ZFWWWQNUSA-N 1 1 391.313 3.190 10 0 GGAEMO C[C@H]([NH2+][C@@H]1CCc2ncnn2C1)c1nnc(-c2ccc(Cl)cc2Cl)o1 ZINC000124117748 564472557 /nfs/dbraw/zinc/47/25/57/564472557.db2.gz OUGAGMVIEGPXSR-GXSJLCMTSA-N 1 1 379.251 3.301 10 0 GGAEMO C[C@H]([NH2+][C@H]1CCc2ncnn2C1)c1nnc(-c2ccc(Cl)cc2Cl)o1 ZINC000124118208 564472568 /nfs/dbraw/zinc/47/25/68/564472568.db2.gz OUGAGMVIEGPXSR-ONGXEEELSA-N 1 1 379.251 3.301 10 0 GGAEMO Cc1cc(NC(=O)N2CCC([N@@H+]3CCO[C@@H](C)C3)CC2)ccc1Br ZINC000124267925 564476997 /nfs/dbraw/zinc/47/69/97/564476997.db2.gz HVWDKGQLMYGCTL-AWEZNQCLSA-N 1 1 396.329 3.475 10 0 GGAEMO Cn1cc([C@H]2CCC[N@H+]2CCC(=O)Nc2cccc(Br)c2)cn1 ZINC000124500312 564483446 /nfs/dbraw/zinc/48/34/46/564483446.db2.gz VHOXTSVXMHQSEU-MRXNPFEDSA-N 1 1 377.286 3.348 10 0 GGAEMO Cn1cc([C@@H]2CCC[N@H+]2CCC(=O)Nc2cccc(Br)c2)cn1 ZINC000124500081 564483850 /nfs/dbraw/zinc/48/38/50/564483850.db2.gz VHOXTSVXMHQSEU-INIZCTEOSA-N 1 1 377.286 3.348 10 0 GGAEMO O=C(CC[N@H+]1CCCC[C@@H]1[C@H]1CNC(=O)C1)Nc1c(Cl)cccc1Cl ZINC000124969597 564499292 /nfs/dbraw/zinc/49/92/92/564499292.db2.gz GHUHULYHTMIYLF-IUODEOHRSA-N 1 1 384.307 3.313 10 0 GGAEMO O=C1C[C@@H]([C@@H]2CCCC[N@@H+]2Cc2cc(Br)cc3cccnc32)CN1 ZINC000125203646 564506392 /nfs/dbraw/zinc/50/63/92/564506392.db2.gz RVMYZUBVPZCXJI-PBHICJAKSA-N 1 1 388.309 3.488 10 0 GGAEMO CCOc1c(Br)cc(C(=O)NCC[N@H+]2CCCC[C@H]2C)cc1OC ZINC000046858550 564508871 /nfs/dbraw/zinc/50/88/71/564508871.db2.gz YLLJBQXLWPELMA-CYBMUJFWSA-N 1 1 399.329 3.461 10 0 GGAEMO COc1ccc(CCC(=O)NCC[N@H+]2CCCC[C@@H]2C)cc1Br ZINC000046860557 564509055 /nfs/dbraw/zinc/50/90/55/564509055.db2.gz DDLDPKLMIQPFEL-AWEZNQCLSA-N 1 1 383.330 3.381 10 0 GGAEMO C[C@H](CNC(=O)N1CCC[C@@H](C(F)(F)F)C1)[N@@H+]1CCc2sccc2C1 ZINC000047010857 564511856 /nfs/dbraw/zinc/51/18/56/564511856.db2.gz MEBFQNLXNWAIBR-TZMCWYRMSA-N 1 1 375.460 3.479 10 0 GGAEMO C[C@H](CNC(=O)N1CCC[C@@H](C(F)(F)F)C1)[N@H+]1CCc2sccc2C1 ZINC000047010857 564511862 /nfs/dbraw/zinc/51/18/62/564511862.db2.gz MEBFQNLXNWAIBR-TZMCWYRMSA-N 1 1 375.460 3.479 10 0 GGAEMO O[C@@H](COC[C@@H]1CCCO1)C[N@@H+](Cc1csc(Br)c1)C1CC1 ZINC000125344662 564512195 /nfs/dbraw/zinc/51/21/95/564512195.db2.gz OMUZSKNMLCCJLF-CABCVRRESA-N 1 1 390.343 3.032 10 0 GGAEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1ccc(-n2cc(Br)cn2)cc1 ZINC000047143860 564513870 /nfs/dbraw/zinc/51/38/70/564513870.db2.gz YVCYTOCUMOPOHK-CQSZACIVSA-N 1 1 391.313 3.239 10 0 GGAEMO Cc1cc(S(=O)(=O)NC2CC[NH+]([C@H](C)c3ccncc3)CC2)c(C)s1 ZINC000125692258 564523772 /nfs/dbraw/zinc/52/37/72/564523772.db2.gz RNRINPGEQROGKO-CQSZACIVSA-N 1 1 379.551 3.264 10 0 GGAEMO C[C@H](C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)N1CC[NH+](C2CC2)CC1 ZINC000126048115 564535272 /nfs/dbraw/zinc/53/52/72/564535272.db2.gz YJXWZYIASDILFN-LLVKDONJSA-N 1 1 375.822 3.466 10 0 GGAEMO COCC[N@H+]1CCCN(C(=O)COc2cc(Cl)c(Cl)cc2Cl)CC1 ZINC000048428675 564539643 /nfs/dbraw/zinc/53/96/43/564539643.db2.gz DIKIIUOKFLJFRL-UHFFFAOYSA-N 1 1 395.714 3.206 10 0 GGAEMO Cc1ccc(Br)c(S(=O)(=O)N[C@H](C[NH+](C)C)c2ccccc2)c1 ZINC000126265833 564543126 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CC[N@H+]1CC[C@@H](CNC(=O)CSCc2ccc(Br)cc2F)C1 ZINC000051469049 564564741 /nfs/dbraw/zinc/56/47/41/564564741.db2.gz WNYDYYINROWDMK-LBPRGKRZSA-N 1 1 389.334 3.279 10 0 GGAEMO C[N@H+](CC(=O)N1CCO[C@H]2CCCC[C@@H]21)Cc1ccc(Br)cc1 ZINC000051453404 564565152 /nfs/dbraw/zinc/56/51/52/564565152.db2.gz RQHOYWDZJCOREL-IRXDYDNUSA-N 1 1 381.314 3.051 10 0 GGAEMO C[N@@H+](CC(=O)N1CCO[C@H]2CCCC[C@@H]21)Cc1ccc(Br)cc1 ZINC000051453404 564565153 /nfs/dbraw/zinc/56/51/53/564565153.db2.gz RQHOYWDZJCOREL-IRXDYDNUSA-N 1 1 381.314 3.051 10 0 GGAEMO COc1cccc(CNC(=O)C[NH2+][C@@H](C)c2ccccc2Br)c1 ZINC000127038731 564571158 /nfs/dbraw/zinc/57/11/58/564571158.db2.gz ASMHYVABIFAZBD-ZDUSSCGKSA-N 1 1 377.282 3.425 10 0 GGAEMO O=c1n2ccccc2nn1CC[N@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000052453482 564572136 /nfs/dbraw/zinc/57/21/36/564572136.db2.gz UXLPJECGNBBLLS-MRXNPFEDSA-N 1 1 387.281 3.096 10 0 GGAEMO O=c1n2ccccc2nn1CC[N@@H+]1CCC[C@@H]1c1ccc(Br)cc1 ZINC000052453482 564572141 /nfs/dbraw/zinc/57/21/41/564572141.db2.gz 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Cc1ccccc1OC[C@@H](O)C[NH+]1CCN(Cc2ccc(Cl)s2)CC1 ZINC000057949612 564677156 /nfs/dbraw/zinc/67/71/56/564677156.db2.gz YVZLQMSVZUAPAC-INIZCTEOSA-N 1 1 380.941 3.267 10 0 GGAEMO Cc1nn(CC(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)cc2)c(C)c1Cl ZINC000130766534 564691853 /nfs/dbraw/zinc/69/18/53/564691853.db2.gz HNOCERSHRCWYJO-MAUKXSAKSA-N 1 1 381.307 3.368 10 0 GGAEMO Cc1nn(CC(=O)N[C@H]2CC[N@H+](C)[C@@H]2c2ccc(Cl)cc2)c(C)c1Cl ZINC000130766534 564691857 /nfs/dbraw/zinc/69/18/57/564691857.db2.gz HNOCERSHRCWYJO-MAUKXSAKSA-N 1 1 381.307 3.368 10 0 GGAEMO CNS(=O)(=O)CCC[N@@H+]1Cc2cc(Cl)ccc2C[C@H]1c1ccccc1 ZINC000130990148 564697645 /nfs/dbraw/zinc/69/76/45/564697645.db2.gz OEXBXONRSOQKML-IBGZPJMESA-N 1 1 378.925 3.379 10 0 GGAEMO CNS(=O)(=O)CCC[N@H+]1Cc2cc(Cl)ccc2C[C@H]1c1ccccc1 ZINC000130990148 564697649 /nfs/dbraw/zinc/69/76/49/564697649.db2.gz OEXBXONRSOQKML-IBGZPJMESA-N 1 1 378.925 3.379 10 0 GGAEMO Brc1csc(-c2noc(CN3CCC[N@H+](C4CC4)CC3)n2)c1 ZINC000061040739 564704168 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CCN(CCc1nccs1)C(=O)[C@@H](c1ccccc1)[NH+]1CCSCC1 ZINC000132042660 564732172 /nfs/dbraw/zinc/73/21/72/564732172.db2.gz GSTJMTKSZKXNJI-GOSISDBHSA-N 1 1 375.563 3.324 10 0 GGAEMO Cc1c(I)cccc1C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000132111991 564733596 /nfs/dbraw/zinc/73/35/96/564733596.db2.gz FZVSQSWTDVGRNM-AGUYFDCRSA-N 1 1 398.288 3.345 10 0 GGAEMO COc1c(Br)cc(Br)cc1C[N@H+](C)[C@@H]1CCOC1 ZINC000132116689 564734562 /nfs/dbraw/zinc/73/45/62/564734562.db2.gz NHLSRGKDEOKXSG-LLVKDONJSA-N 1 1 379.092 3.441 10 0 GGAEMO COc1c(Br)cc(Br)cc1C[N@@H+](C)[C@@H]1CCOC1 ZINC000132116689 564734564 /nfs/dbraw/zinc/73/45/64/564734564.db2.gz NHLSRGKDEOKXSG-LLVKDONJSA-N 1 1 379.092 3.441 10 0 GGAEMO Cc1c(Br)cccc1C[N@@H+](CC(=O)N1CCCC1)C[C@@H]1CCCO1 ZINC000132311977 564739855 /nfs/dbraw/zinc/73/98/55/564739855.db2.gz LATAEIVGCMKGDB-KRWDZBQOSA-N 1 1 395.341 3.361 10 0 GGAEMO Cc1c(Br)cccc1C[N@H+](CC(=O)N1CCCC1)C[C@@H]1CCCO1 ZINC000132311977 564739858 /nfs/dbraw/zinc/73/98/58/564739858.db2.gz LATAEIVGCMKGDB-KRWDZBQOSA-N 1 1 395.341 3.361 10 0 GGAEMO CC(C)[N@@H+]1C[C@H](NC(=O)N2CCC(C(F)(F)F)(C(F)(F)F)C2)[C@@H](C)C1 ZINC000132320556 564740755 /nfs/dbraw/zinc/74/07/55/564740755.db2.gz PAODHZHFKVWCCX-QWRGUYRKSA-N 1 1 375.357 3.241 10 0 GGAEMO CCN(CC)C(=O)[C@@H]1CCC[N@H+]1C[C@H](O)COc1ccc(Cl)cc1Cl ZINC000065297722 564742007 /nfs/dbraw/zinc/74/20/07/564742007.db2.gz GHUHREAHBONCCM-HOCLYGCPSA-N 1 1 389.323 3.066 10 0 GGAEMO O[C@H](COC[C@@H]1CCCO1)C[N@H+]1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1 ZINC000132858850 564755282 /nfs/dbraw/zinc/75/52/82/564755282.db2.gz CFGGATKKCTZRGK-IMJJTQAJSA-N 1 1 390.307 3.003 10 0 GGAEMO Cc1ccn(-c2ccccc2C[NH2+][C@@H](C(N)=O)c2ccc(Br)cc2)n1 ZINC000133112949 564763557 /nfs/dbraw/zinc/76/35/57/564763557.db2.gz UHNWRLBKRDLTTK-GOSISDBHSA-N 1 1 399.292 3.259 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2ccc(Br)cc2C)[C@H](C)C1 ZINC000133385331 564771917 /nfs/dbraw/zinc/77/19/17/564771917.db2.gz JXSKASXYGMKWJC-UKRRQHHQSA-N 1 1 389.359 3.108 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2ccc(Br)cc2C)[C@H](C)C1 ZINC000133385122 564772117 /nfs/dbraw/zinc/77/21/17/564772117.db2.gz JXSKASXYGMKWJC-HIFRSBDPSA-N 1 1 389.359 3.108 10 0 GGAEMO CC(=O)NCc1ccc(C(=O)NC[C@@H](c2ccccc2Cl)[NH+](C)C)s1 ZINC000067131091 564784886 /nfs/dbraw/zinc/78/48/86/564784886.db2.gz VABUJEQBGBUJRU-INIZCTEOSA-N 1 1 379.913 3.070 10 0 GGAEMO C[C@H]([C@H]1Cc2ccccc2O1)[N@H+](C)CC(=O)Nc1ccc(Br)cn1 ZINC000134253916 564798511 /nfs/dbraw/zinc/79/85/11/564798511.db2.gz IUXCWLAISNXBNA-MLGOLLRUSA-N 1 1 390.281 3.107 10 0 GGAEMO C[C@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)CC(=O)Nc1ccc(Br)cn1 ZINC000134253916 564798515 /nfs/dbraw/zinc/79/85/15/564798515.db2.gz IUXCWLAISNXBNA-MLGOLLRUSA-N 1 1 390.281 3.107 10 0 GGAEMO C[C@@H]1C[N@H+](Cc2cccc(CNC(=O)c3coc(Br)c3)c2)CCO1 ZINC000067809178 564800074 /nfs/dbraw/zinc/80/00/74/564800074.db2.gz BJRULRUSNHFFBW-CYBMUJFWSA-N 1 1 393.281 3.193 10 0 GGAEMO C[C@@H]1C[N@@H+](Cc2cccc(CNC(=O)c3coc(Br)c3)c2)CCO1 ZINC000067809178 564800077 /nfs/dbraw/zinc/80/00/77/564800077.db2.gz BJRULRUSNHFFBW-CYBMUJFWSA-N 1 1 393.281 3.193 10 0 GGAEMO Cc1cc(NC(=O)c2ccnc(N3CC[NH+](C)CC3)c2)ccc1Br ZINC000068316008 564815237 /nfs/dbraw/zinc/81/52/37/564815237.db2.gz UHWHACOOGKJKEF-UHFFFAOYSA-N 1 1 389.297 3.157 10 0 GGAEMO CC(C)(C)[N@H+](Cc1ccccc1Br)C[C@H](O)CN1CCCC1=O ZINC000134865649 564817342 /nfs/dbraw/zinc/81/73/42/564817342.db2.gz GVNDGWNEVMWNEJ-OAHLLOKOSA-N 1 1 383.330 3.033 10 0 GGAEMO CC[N@H+]1CC[C@H](CNCc2ncc(Br)cc2Br)C1 ZINC000135293266 564826803 /nfs/dbraw/zinc/82/68/03/564826803.db2.gz KVZCYBCYKUYHTI-SNVBAGLBSA-N 1 1 377.124 3.038 10 0 GGAEMO CC[N@H+]1CCC[C@H](NCc2ncc(Br)cc2Br)C1 ZINC000135296714 564827031 /nfs/dbraw/zinc/82/70/31/564827031.db2.gz SOSNDTRNYBMGSS-NSHDSACASA-N 1 1 377.124 3.181 10 0 GGAEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cnc(-c2ccccc2Cl)s1 ZINC000069502345 564840897 /nfs/dbraw/zinc/84/08/97/564840897.db2.gz ZDANBFHFRMKHLB-CYBMUJFWSA-N 1 1 379.913 3.304 10 0 GGAEMO 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C[C@@H]1CC[N@@H+](Cc2cc3c(cc2Br)OCCO3)C[C@@H]1n1ccnc1 ZINC000156518302 565092808 /nfs/dbraw/zinc/09/28/08/565092808.db2.gz HZRFLIXCLRHLTR-CJNGLKHVSA-N 1 1 392.297 3.500 10 0 GGAEMO C[C@@H]1C[C@H](N(C)C(=O)N[C@H]2CCOc3ccc(Br)cc32)CC[N@H+]1C ZINC000266833216 565092989 /nfs/dbraw/zinc/09/29/89/565092989.db2.gz ZQFQRFNXAUQALZ-XPKDYRNWSA-N 1 1 396.329 3.397 10 0 GGAEMO CN(CC1CC1)C(=O)C[NH+]1CCC(Oc2cccc(Br)c2)CC1 ZINC000183821672 565096637 /nfs/dbraw/zinc/09/66/37/565096637.db2.gz DDQKFSXTUCBCJH-UHFFFAOYSA-N 1 1 381.314 3.161 10 0 GGAEMO CCC[N@@H+](CC)CCNC(=O)c1ncc(Br)cc1Br ZINC000183842783 565098508 /nfs/dbraw/zinc/09/85/08/565098508.db2.gz FEZUSSOKEFKFJP-UHFFFAOYSA-N 1 1 393.123 3.068 10 0 GGAEMO OC[C@@H]([NH2+]Cc1cc(F)cc2c1OCOC2)c1cccc(Br)c1 ZINC000183892214 565101311 /nfs/dbraw/zinc/10/13/11/565101311.db2.gz JQPOJDXMKOLWQC-MRXNPFEDSA-N 1 1 382.229 3.278 10 0 GGAEMO C[C@@H]1CCCC[C@H]1N(C)C(=O)C[NH2+][C@@H](CO)c1cccc(Br)c1 ZINC000183896650 565101403 /nfs/dbraw/zinc/10/14/03/565101403.db2.gz XUTLAFSATFDUSS-XOKHGSTOSA-N 1 1 383.330 3.109 10 0 GGAEMO COc1ccc(C)cc1NC(=O)C[NH2+][C@H](CO)c1cccc(Br)c1 ZINC000183887086 565101613 /nfs/dbraw/zinc/10/16/13/565101613.db2.gz KNEVRXNVHDXUHS-MRXNPFEDSA-N 1 1 393.281 3.028 10 0 GGAEMO Cc1ccc(C)c(NC(=O)C[NH2+][C@@H](CO)c2cccc(Br)c2)c1 ZINC000183908170 565102544 /nfs/dbraw/zinc/10/25/44/565102544.db2.gz FKZLJCWQVSXMMK-KRWDZBQOSA-N 1 1 377.282 3.328 10 0 GGAEMO C[C@H]1Cc2ccccc2N1C(=O)C[NH2+][C@H](CO)c1cccc(Br)c1 ZINC000183905403 565102868 /nfs/dbraw/zinc/10/28/68/565102868.db2.gz UVOWSJMAQDTBPY-SUMWQHHRSA-N 1 1 389.293 3.050 10 0 GGAEMO O=C(C[NH2+][C@H](CO)c1cccc(Br)c1)Nc1cccc(Cl)c1 ZINC000183911480 565102960 /nfs/dbraw/zinc/10/29/60/565102960.db2.gz CSWQQOLCIGDDJR-OAHLLOKOSA-N 1 1 383.673 3.364 10 0 GGAEMO CCc1ccc(NC(=O)C[NH2+][C@H](CO)c2cccc(Br)c2)cc1 ZINC000183903033 565102998 /nfs/dbraw/zinc/10/29/98/565102998.db2.gz KIRVZABSMNCPMZ-QGZVFWFLSA-N 1 1 377.282 3.273 10 0 GGAEMO C[N@H+]1CCC[C@@H](CNS(=O)(=O)Cc2ccc(F)cc2)[C@@H]1c1cccs1 ZINC000369674717 565104515 /nfs/dbraw/zinc/10/45/15/565104515.db2.gz YMFMQBOEEJENJA-MAUKXSAKSA-N 1 1 382.526 3.390 10 0 GGAEMO COc1ccccc1CC[N@H+](C)[C@H](C(N)=O)c1cccc(Br)c1 ZINC000156801864 565106841 /nfs/dbraw/zinc/10/68/41/565106841.db2.gz JDNVJZAUDNQSSJ-KRWDZBQOSA-N 1 1 377.282 3.159 10 0 GGAEMO COc1ccccc1CC[N@@H+](C)[C@H](C(N)=O)c1cccc(Br)c1 ZINC000156801864 565106844 /nfs/dbraw/zinc/10/68/44/565106844.db2.gz JDNVJZAUDNQSSJ-KRWDZBQOSA-N 1 1 377.282 3.159 10 0 GGAEMO O[C@@H](CC1CCCC1)C[NH+]1CCC(O)(c2scnc2Br)CC1 ZINC000369703078 565107644 /nfs/dbraw/zinc/10/76/44/565107644.db2.gz LNVMYSPBRQOFPX-ZDUSSCGKSA-N 1 1 389.359 3.130 10 0 GGAEMO CC[N@@H+](C)C[C@H]1CCN(C(=O)N[C@@H]2CCOc3ccc(Br)cc32)C1 ZINC000267328378 565113761 /nfs/dbraw/zinc/11/37/61/565113761.db2.gz QBLSINQMBZHFRF-CZUORRHYSA-N 1 1 396.329 3.256 10 0 GGAEMO CCN(CC)S(=O)(=O)c1ccc(SCCCCn2cc[nH+]c2C)nc1 ZINC000157185602 565122835 /nfs/dbraw/zinc/12/28/35/565122835.db2.gz ZMSUWCRVAWGCFD-UHFFFAOYSA-N 1 1 382.555 3.190 10 0 GGAEMO CCN(CC)c1ncc(C[N@@H+]2CCCN(Cc3csc(C)n3)CC2)s1 ZINC000157227957 565123923 /nfs/dbraw/zinc/12/39/23/565123923.db2.gz NNQHUNOJVXTIEZ-UHFFFAOYSA-N 1 1 379.599 3.462 10 0 GGAEMO CCN(CC)c1ncc(C[N@H+]2CCCN(Cc3csc(C)n3)CC2)s1 ZINC000157227957 565123928 /nfs/dbraw/zinc/12/39/28/565123928.db2.gz NNQHUNOJVXTIEZ-UHFFFAOYSA-N 1 1 379.599 3.462 10 0 GGAEMO CCc1[nH+]ccn1[C@@H]1CCCN([C@H](C(N)=O)c2cccc(Br)c2)C1 ZINC000157228908 565124386 /nfs/dbraw/zinc/12/43/86/565124386.db2.gz NPZKQTZYPDYYCY-WBVHZDCISA-N 1 1 391.313 3.072 10 0 GGAEMO Cc1nn(C)c(CN2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)c1Br ZINC000370148622 565130918 /nfs/dbraw/zinc/13/09/18/565130918.db2.gz BOSUEWMVLGPHHY-CQSZACIVSA-N 1 1 392.345 3.403 10 0 GGAEMO C[N@H+]1CC[C@@]2(CCN(C(=O)N[C@@H]3CCOc4c(Br)cccc43)C2)C1 ZINC000292740821 565131985 /nfs/dbraw/zinc/13/19/85/565131985.db2.gz TXEDWNILDYFDIJ-CRAIPNDOSA-N 1 1 394.313 3.010 10 0 GGAEMO COc1cc(OC)c(NC(=O)C[N@H+](C)CCc2ncc(C)s2)cc1Cl ZINC000157497565 565133525 /nfs/dbraw/zinc/13/35/25/565133525.db2.gz AMQAFHKXQNWMIQ-UHFFFAOYSA-N 1 1 383.901 3.235 10 0 GGAEMO COc1cc(OC)c(NC(=O)C[N@@H+](C)CCc2ncc(C)s2)cc1Cl ZINC000157497565 565133530 /nfs/dbraw/zinc/13/35/30/565133530.db2.gz AMQAFHKXQNWMIQ-UHFFFAOYSA-N 1 1 383.901 3.235 10 0 GGAEMO COc1cc(C)c(Br)cc1NC(=O)N1C[C@H]2CCC[N@H+]2C[C@@H]1C ZINC000184536781 565142578 /nfs/dbraw/zinc/14/25/78/565142578.db2.gz QXQJHVMKYLWCPO-QWHCGFSZSA-N 1 1 382.302 3.467 10 0 GGAEMO C[C@@H]([NH2+]Cc1c(Br)cnn1C)c1ccc(-n2cccn2)c(F)c1 ZINC000292964982 565143644 /nfs/dbraw/zinc/14/36/44/565143644.db2.gz LSXCZVKTJRYCTE-LLVKDONJSA-N 1 1 378.249 3.358 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NC(=O)c1cccnc1Br ZINC000268255987 565145630 /nfs/dbraw/zinc/14/56/30/565145630.db2.gz XYLFRYVCZIPIHA-WMLDXEAASA-N 1 1 388.309 3.485 10 0 GGAEMO CCn1nc2c(cc1=O)C[N@@H+](Cc1cc(Br)cc3cccnc31)CC2 ZINC000370479932 565145984 /nfs/dbraw/zinc/14/59/84/565145984.db2.gz KEUXYIZUHHXTQP-UHFFFAOYSA-N 1 1 399.292 3.132 10 0 GGAEMO CCn1nc2c(cc1=O)C[N@H+](Cc1cc(Br)cc3cccnc31)CC2 ZINC000370479932 565145989 /nfs/dbraw/zinc/14/59/89/565145989.db2.gz KEUXYIZUHHXTQP-UHFFFAOYSA-N 1 1 399.292 3.132 10 0 GGAEMO CO[C@@H]1CC[C@@H]2OCC[N@@H+](CCC(=O)Nc3cccc(Br)c3)[C@@H]2C1 ZINC000157904698 565148999 /nfs/dbraw/zinc/14/89/99/565148999.db2.gz XDGHEFYRFBJDRY-ZACQAIPSSA-N 1 1 397.313 3.046 10 0 GGAEMO CC[N@H+]1CCC[C@H](NC(=O)NCc2cc3cc(Br)ccc3[nH]2)C1 ZINC000184738617 565155221 /nfs/dbraw/zinc/15/52/21/565155221.db2.gz ZHBBBRNEWHTKOX-AWEZNQCLSA-N 1 1 379.302 3.214 10 0 GGAEMO CCOCCOc1ccc(Br)cc1C[NH2+][C@H]1CCc2[nH]cnc2C1 ZINC000370730501 565158560 /nfs/dbraw/zinc/15/85/60/565158560.db2.gz OORCWTDTJFVVQG-HNNXBMFYSA-N 1 1 394.313 3.235 10 0 GGAEMO Cc1cc(C(=O)NC2CC[NH+](Cc3cccc(Br)c3)CC2)no1 ZINC000370814661 565162974 /nfs/dbraw/zinc/16/29/74/565162974.db2.gz NGQMBKRPQNVEMS-UHFFFAOYSA-N 1 1 378.270 3.140 10 0 GGAEMO CN(C(=O)c1cc(Cl)sc1Cl)[C@@H]1CC[N@@H+](C2CCN(C)CC2)C1 ZINC000370831396 565163882 /nfs/dbraw/zinc/16/38/82/565163882.db2.gz USHPUTYQBIWURG-GFCCVEGCSA-N 1 1 376.353 3.295 10 0 GGAEMO CN(C(=O)c1cc(Cl)sc1Cl)[C@@H]1CC[N@H+](C2CCN(C)CC2)C1 ZINC000370831396 565163888 /nfs/dbraw/zinc/16/38/88/565163888.db2.gz USHPUTYQBIWURG-GFCCVEGCSA-N 1 1 376.353 3.295 10 0 GGAEMO CC(C)Oc1cc(Br)ccc1C(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000370903595 565166916 /nfs/dbraw/zinc/16/69/16/565166916.db2.gz VVZPTQNTPWVOAS-LBPRGKRZSA-N 1 1 378.270 3.247 10 0 GGAEMO CO[C@@H]1CC[C@@H]2OCC[N@@H+](CCC(=O)Nc3ccc(Br)cc3)[C@@H]2C1 ZINC000158353587 565167264 /nfs/dbraw/zinc/16/72/64/565167264.db2.gz PUIQHKHDDUOGET-ZACQAIPSSA-N 1 1 397.313 3.046 10 0 GGAEMO CO[C@@H]1CC[C@H]2OCC[N@@H+](CCC(=O)Nc3ccc(Br)cc3)[C@@H]2C1 ZINC000158353301 565167282 /nfs/dbraw/zinc/16/72/82/565167282.db2.gz PUIQHKHDDUOGET-BRWVUGGUSA-N 1 1 397.313 3.046 10 0 GGAEMO C[C@H]1C[N@H+](C2CCN(Cc3nc4cc(Br)ccc4[nH]3)CC2)CCO1 ZINC000184953052 565167522 /nfs/dbraw/zinc/16/75/22/565167522.db2.gz PCBSIRQJWSFVSS-ZDUSSCGKSA-N 1 1 393.329 3.011 10 0 GGAEMO C[C@H]1C[N@@H+](C2CCN(Cc3nc4ccc(Br)cc4[nH]3)CC2)CCO1 ZINC000184953052 565167528 /nfs/dbraw/zinc/16/75/28/565167528.db2.gz PCBSIRQJWSFVSS-ZDUSSCGKSA-N 1 1 393.329 3.011 10 0 GGAEMO C[C@H]1C[N@H+](C2CCN(Cc3nc4ccc(Br)cc4[nH]3)CC2)CCO1 ZINC000184953052 565167533 /nfs/dbraw/zinc/16/75/33/565167533.db2.gz PCBSIRQJWSFVSS-ZDUSSCGKSA-N 1 1 393.329 3.011 10 0 GGAEMO CCO[C@H]1C[C@H](O)C12CC[NH+](Cc1nc3cc(Br)ccc3[nH]1)CC2 ZINC000184974133 565168791 /nfs/dbraw/zinc/16/87/91/565168791.db2.gz VNTZVAFLDONMOC-HOTGVXAUSA-N 1 1 394.313 3.077 10 0 GGAEMO C[C@@H]1C[C@H](N(C)C(=O)Cc2c[nH]c3cc(Br)ccc23)CC[N@H+]1C ZINC000158449898 565170084 /nfs/dbraw/zinc/17/00/84/565170084.db2.gz ZDOQPQKSGQWRIG-IUODEOHRSA-N 1 1 378.314 3.414 10 0 GGAEMO Cc1nc(C[C@H]2CCC[N@H+](C[C@H](O)c3ccc(F)c(Br)c3)C2)no1 ZINC000184992997 565170575 /nfs/dbraw/zinc/17/05/75/565170575.db2.gz VVSLGTOQSVRHPP-WBMJQRKESA-N 1 1 398.276 3.268 10 0 GGAEMO Cc1nc(C[C@H]2CCC[N@@H+](C[C@H](O)c3ccc(F)c(Br)c3)C2)no1 ZINC000184992997 565170578 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ZINC000171509503 565434815 /nfs/dbraw/zinc/43/48/15/565434815.db2.gz AEHCIHKFLYFXHS-UHFFFAOYSA-N 1 1 378.270 3.287 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)Cc1cccc(Br)c1C ZINC000188958663 565435585 /nfs/dbraw/zinc/43/55/85/565435585.db2.gz UNXQUPAZRXXTCS-MRXNPFEDSA-N 1 1 376.298 3.496 10 0 GGAEMO Cc1cnn([C@@H]2CCC[N@@H+](C[C@H](O)COc3cccc(Br)c3)C2)c1 ZINC000171529488 565436191 /nfs/dbraw/zinc/43/61/91/565436191.db2.gz BEOQJFBOKBVMGO-SJORKVTESA-N 1 1 394.313 3.031 10 0 GGAEMO COc1ccc([C@@H](C)NC(=O)N2CC[N@H+]3CCCC[C@@H]3C2)cc1Br ZINC000171597644 565439341 /nfs/dbraw/zinc/43/93/41/565439341.db2.gz KLTXYHGGSAANST-UKRRQHHQSA-N 1 1 396.329 3.398 10 0 GGAEMO COc1cc(Br)ccc1[C@@H](C)NC(=O)[C@H](C)[NH+]1CCSCC1 ZINC000189138980 565446140 /nfs/dbraw/zinc/44/61/40/565446140.db2.gz DAEDCSFSXVTNHW-NEPJUHHUSA-N 1 1 387.343 3.072 10 0 GGAEMO C[C@H](C(=O)Nc1ccc(Cl)cc1C(F)(F)F)N1CC[NH+](C2CC2)CC1 ZINC000299342631 565446783 /nfs/dbraw/zinc/44/67/83/565446783.db2.gz OVVBMNFZFLBGIE-LLVKDONJSA-N 1 1 375.822 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C[C@H](c1cccc(NCc2c(Br)cnn2C)c1)[NH+]1CCOCC1 ZINC000278538820 565564357 /nfs/dbraw/zinc/56/43/57/565564357.db2.gz SVBLBVAYAAXXOX-CYBMUJFWSA-N 1 1 379.302 3.188 10 0 GGAEMO CCOC(=O)C1CCC(O)(C[N@@H+](C)CCc2ccc(Br)cc2)CC1 ZINC000190872606 565566613 /nfs/dbraw/zinc/56/66/13/565566613.db2.gz BREHIISXEWAMOQ-UHFFFAOYSA-N 1 1 398.341 3.408 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccccc2)CC[C@H]1NCc1c(Br)cnn1C ZINC000278580834 565566756 /nfs/dbraw/zinc/56/67/56/565566756.db2.gz YNIRIDSVEWWAQI-WMLDXEAASA-N 1 1 377.330 3.183 10 0 GGAEMO COCC[N@@H+]1CCN(C(=O)Nc2cc(Br)c(F)cc2C)C[C@H]1C ZINC000190877668 565567058 /nfs/dbraw/zinc/56/70/58/565567058.db2.gz FXFDNGFETPOYPP-GFCCVEGCSA-N 1 1 388.281 3.081 10 0 GGAEMO COCC[N@H+]1CCN(C(=O)Nc2cc(Br)c(F)cc2C)C[C@H]1C ZINC000190877668 565567064 /nfs/dbraw/zinc/56/70/64/565567064.db2.gz FXFDNGFETPOYPP-GFCCVEGCSA-N 1 1 388.281 3.081 10 0 GGAEMO Cn1ncc(Br)c1C[NH2+]C[C@H](O)c1c(Cl)cccc1Cl ZINC000278591715 565568437 /nfs/dbraw/zinc/56/84/37/565568437.db2.gz 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Brc1ccc(-c2cnc(C[N@@H+]3CC[C@@H](N4CCOCC4)C3)o2)cc1 ZINC000173904080 565598291 /nfs/dbraw/zinc/59/82/91/565598291.db2.gz CFMXGRWYOJMHEG-MRXNPFEDSA-N 1 1 392.297 3.011 10 0 GGAEMO Brc1ccc(-c2cnc(C[N@H+]3CC[C@@H](N4CCOCC4)C3)o2)cc1 ZINC000173904080 565598295 /nfs/dbraw/zinc/59/82/95/565598295.db2.gz CFMXGRWYOJMHEG-MRXNPFEDSA-N 1 1 392.297 3.011 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(S(=O)(=O)c2ccc(C)cc2Br)CC1 ZINC000408191200 565598420 /nfs/dbraw/zinc/59/84/20/565598420.db2.gz DRDSYWQRWNLGMT-UHFFFAOYSA-N 1 1 398.326 3.288 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)NCCCCn1cc[nH+]c1C ZINC000173906885 565598579 /nfs/dbraw/zinc/59/85/79/565598579.db2.gz SHUKUPRHRPBFRS-UHFFFAOYSA-N 1 1 380.286 3.102 10 0 GGAEMO O=C(CCC[N@@H+]1CC[C@](O)(C(F)(F)F)C1)c1ccc(Br)cc1 ZINC000319389752 565599074 /nfs/dbraw/zinc/59/90/74/565599074.db2.gz KTKPDZZOVTZNRY-CQSZACIVSA-N 1 1 380.204 3.411 10 0 GGAEMO C[C@H](O)C[N@H+]1CCN(C(=O)N[C@H]2CCc3c2ccc(Cl)c3Cl)C[C@H]1C ZINC000408209898 565599224 /nfs/dbraw/zinc/59/92/24/565599224.db2.gz WSPZDXSLCJDRFQ-WQGACYEGSA-N 1 1 386.323 3.077 10 0 GGAEMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Nc1cnn(-c2ncc(Cl)cc2Cl)c1 ZINC000408209363 565599685 /nfs/dbraw/zinc/59/96/85/565599685.db2.gz ZXYYGNVUBYELFC-WDEREUQCSA-N 1 1 383.283 3.130 10 0 GGAEMO C[C@@H]1C[NH+](C[C@H]2CCCN2C(=O)Nc2cc(Cl)c(Cl)cn2)C[C@@H](C)O1 ZINC000408350547 565604955 /nfs/dbraw/zinc/60/49/55/565604955.db2.gz SDHMNCMFDHIIRF-JHJVBQTASA-N 1 1 387.311 3.494 10 0 GGAEMO Cc1c(Br)cccc1CC(=O)N1CCC([N@@H+]2CCO[C@@H](C)C2)CC1 ZINC000191516175 565610572 /nfs/dbraw/zinc/61/05/72/565610572.db2.gz RCKHEJMMEFRLLD-AWEZNQCLSA-N 1 1 395.341 3.012 10 0 GGAEMO NC(=O)[C@H]([NH2+]CCCc1cccc(F)c1)c1ccc(Br)cc1F ZINC000174073985 565611668 /nfs/dbraw/zinc/61/16/68/565611668.db2.gz VUFWWJOMYUKARP-MRXNPFEDSA-N 1 1 383.236 3.476 10 0 GGAEMO O=c1c2cccc(Br)c2ncn1Cc1[nH+]ccn1Cc1ccccc1 ZINC000174112639 565614605 /nfs/dbraw/zinc/61/46/05/565614605.db2.gz ZOJSPRNFXKTUOJ-UHFFFAOYSA-N 1 1 395.260 3.452 10 0 GGAEMO Cn1ncc(Br)c1CN1CCC(c2[nH+]cc3n2CCCC3)CC1 ZINC000279492946 565615674 /nfs/dbraw/zinc/61/56/74/565615674.db2.gz VADTWUFGEIMIGA-UHFFFAOYSA-N 1 1 378.318 3.095 10 0 GGAEMO COc1c(C)c[nH+]c(CN2CCN(c3ccc(Br)cn3)CC2)c1C ZINC000409448387 565616195 /nfs/dbraw/zinc/61/61/95/565616195.db2.gz INKMVIYOCWLQJI-UHFFFAOYSA-N 1 1 391.313 3.187 10 0 GGAEMO C[C@@H]1C[C@H](N(C)CC(=O)Nc2c(F)cc(F)cc2Br)CC[N@H+]1C ZINC000174173265 565618825 /nfs/dbraw/zinc/61/88/25/565618825.db2.gz UTKNNHHRIOCUDY-ZYHUDNBSSA-N 1 1 390.272 3.080 10 0 GGAEMO C[C@H]1C[C@@H](N(C)CC(=O)Nc2c(F)cc(F)cc2Br)CC[N@H+]1C ZINC000174173308 565619089 /nfs/dbraw/zinc/61/90/89/565619089.db2.gz UTKNNHHRIOCUDY-JQWIXIFHSA-N 1 1 390.272 3.080 10 0 GGAEMO COc1ccc(C[N@@H+]2CCCC[C@@H]2CN2CCOCC2)cc1Br ZINC000174177738 565619103 /nfs/dbraw/zinc/61/91/03/565619103.db2.gz OHDGRJLAQRINIK-MRXNPFEDSA-N 1 1 383.330 3.144 10 0 GGAEMO COc1ccc(C[N@H+]2CCCC[C@@H]2CN2CCOCC2)cc1Br ZINC000174177738 565619108 /nfs/dbraw/zinc/61/91/08/565619108.db2.gz OHDGRJLAQRINIK-MRXNPFEDSA-N 1 1 383.330 3.144 10 0 GGAEMO COc1ccc(CN2CCCC[C@@H]2C[NH+]2CCOCC2)cc1Br ZINC000174177738 565619112 /nfs/dbraw/zinc/61/91/12/565619112.db2.gz OHDGRJLAQRINIK-MRXNPFEDSA-N 1 1 383.330 3.144 10 0 GGAEMO C[C@@H](Oc1ccccc1Br)C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000174203361 565620562 /nfs/dbraw/zinc/62/05/62/565620562.db2.gz PBSGIQJOKXTZRP-FFHGMXDLSA-N 1 1 381.314 3.348 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)C(=O)Nc2ccccc2I)CC[N@H+]1C ZINC000174234820 565622457 /nfs/dbraw/zinc/62/24/57/565622457.db2.gz RHPKSNWFVUDEQK-NEPJUHHUSA-N 1 1 387.265 3.238 10 0 GGAEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)N[C@H](C)c1ccc(Br)cn1 ZINC000279595028 565622589 /nfs/dbraw/zinc/62/25/89/565622589.db2.gz DAARASYJOYTAAX-IUODEOHRSA-N 1 1 392.301 3.284 10 0 GGAEMO COCC[N@@H+]1CCN(C(=O)Nc2cccc(Cl)c2Br)C[C@H]1C ZINC000191733631 565626584 /nfs/dbraw/zinc/62/65/84/565626584.db2.gz VTJMDNZPSUQKAU-LLVKDONJSA-N 1 1 390.709 3.287 10 0 GGAEMO COCC[N@H+]1CCN(C(=O)Nc2cccc(Cl)c2Br)C[C@H]1C ZINC000191733631 565626587 /nfs/dbraw/zinc/62/65/87/565626587.db2.gz VTJMDNZPSUQKAU-LLVKDONJSA-N 1 1 390.709 3.287 10 0 GGAEMO C[C@H]1C[C@@H](N(C)C(=O)Nc2ccc(I)cc2)CC[N@H+]1C ZINC000174288795 565627141 /nfs/dbraw/zinc/62/71/41/565627141.db2.gz PFOQJZUAVDHQRB-FZMZJTMJSA-N 1 1 387.265 3.238 10 0 GGAEMO C[C@@H](O)C[N@@H+]1CCN(C(=O)c2ccc(C3SCCCS3)cc2)C[C@@H]1C ZINC000174311215 565628491 /nfs/dbraw/zinc/62/84/91/565628491.db2.gz FARJBAWSWGQVMV-LSDHHAIUSA-N 1 1 380.579 3.082 10 0 GGAEMO C[C@@H](O)C[N@H+]1CCN(C(=O)c2ccc(C3SCCCS3)cc2)C[C@@H]1C ZINC000174311215 565628493 /nfs/dbraw/zinc/62/84/93/565628493.db2.gz FARJBAWSWGQVMV-LSDHHAIUSA-N 1 1 380.579 3.082 10 0 GGAEMO O=C1[C@@H]([NH2+]Cc2ccccc2Br)CCN1Cc1ccc(F)cc1 ZINC000191775392 565630636 /nfs/dbraw/zinc/63/06/36/565630636.db2.gz ZHABITSFJCWTNH-KRWDZBQOSA-N 1 1 377.257 3.479 10 0 GGAEMO COCc1csc(NC(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)n1 ZINC000174388118 565632364 /nfs/dbraw/zinc/63/23/64/565632364.db2.gz WKIJLPAHBZBLOS-ZDUSSCGKSA-N 1 1 380.539 3.385 10 0 GGAEMO C[C@@H]1C[C@H](NC(=O)N[C@@H]2CCOc3c(Br)cccc32)CC[N@H+]1C ZINC000409697760 565633359 /nfs/dbraw/zinc/63/33/59/565633359.db2.gz NKQZWEVDNCZURU-LALPHHSUSA-N 1 1 382.302 3.055 10 0 GGAEMO CCC[N@H+]1CC[C@H](CNC(=O)N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000409700342 565634454 /nfs/dbraw/zinc/63/44/54/565634454.db2.gz LQMLOXDFAPKYRJ-CZUORRHYSA-N 1 1 396.329 3.304 10 0 GGAEMO CC(C)OC[C@@H](O)C[N@@H+]1CCC[C@@H]1c1ccc(I)cc1 ZINC000174429107 565634717 /nfs/dbraw/zinc/63/47/17/565634717.db2.gz OZQQKSLHCFGVKH-JKSUJKDBSA-N 1 1 389.277 3.214 10 0 GGAEMO CC(C)OC[C@@H](O)C[N@H+]1CCC[C@@H]1c1ccc(I)cc1 ZINC000174429107 565634724 /nfs/dbraw/zinc/63/47/24/565634724.db2.gz OZQQKSLHCFGVKH-JKSUJKDBSA-N 1 1 389.277 3.214 10 0 GGAEMO CCC[N@H+]1CC[C@@H](CNC(=O)N[C@@H]2CCOc3c(Br)cccc32)C1 ZINC000409700343 565634998 /nfs/dbraw/zinc/63/49/98/565634998.db2.gz LQMLOXDFAPKYRJ-XJKSGUPXSA-N 1 1 396.329 3.304 10 0 GGAEMO COc1ccc(Br)cc1CNC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000174458071 565638236 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10 0 GGAEMO O=C1[C@H]([N@@H+]2CC[C@]3(O)CCCC[C@@H]3C2)CCN1c1cccc(Br)c1 ZINC000192074481 565655761 /nfs/dbraw/zinc/65/57/61/565655761.db2.gz PSBOXSRWWJMZMH-LSBZLQRGSA-N 1 1 393.325 3.181 10 0 GGAEMO Cc1cnc(CC[N@@H+](C)[C@@H]2CCN(c3cccc(Br)c3)C2=O)s1 ZINC000192075278 565656873 /nfs/dbraw/zinc/65/68/73/565656873.db2.gz DYDDWOSJQOUQAK-OAHLLOKOSA-N 1 1 394.338 3.494 10 0 GGAEMO Cc1cnc(CC[N@H+](C)[C@@H]2CCN(c3cccc(Br)c3)C2=O)s1 ZINC000192075278 565656876 /nfs/dbraw/zinc/65/68/76/565656876.db2.gz DYDDWOSJQOUQAK-OAHLLOKOSA-N 1 1 394.338 3.494 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)CC(=O)Nc2ccc(Br)cc2C)[C@H](C)C1 ZINC000174777380 565658544 /nfs/dbraw/zinc/65/85/44/565658544.db2.gz DVTMKHMTYHIZGS-PBHICJAKSA-N 1 1 382.346 3.358 10 0 GGAEMO Cc1ccc(NC(=O)N2CCCC[C@H]2C[NH+]2CCOCC2)cc1Br ZINC000174808441 565661650 /nfs/dbraw/zinc/66/16/50/565661650.db2.gz IKNURILVLOHSSC-INIZCTEOSA-N 1 1 396.329 3.476 10 0 GGAEMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1S(=O)(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000329299958 565661719 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GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2c[nH]c3ncc(Br)cc23)[C@@H](C)C1 ZINC000280495906 565675361 /nfs/dbraw/zinc/67/53/61/565675361.db2.gz WCBNNDWAPKKMJL-XHDPSFHLSA-N 1 1 379.302 3.128 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2c[nH]c3ncc(Br)cc23)[C@H](C)C1 ZINC000280495904 565675627 /nfs/dbraw/zinc/67/56/27/565675627.db2.gz WCBNNDWAPKKMJL-IAQYHMDHSA-N 1 1 379.302 3.128 10 0 GGAEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1CC(=O)Nc1ccc(Br)cc1F ZINC000175031880 565675907 /nfs/dbraw/zinc/67/59/07/565675907.db2.gz FLHGTNPSXYJTAZ-UONOGXRCSA-N 1 1 384.293 3.085 10 0 GGAEMO O[C@]12CCCC[C@H]1C[N@H+](Cc1cn(-c3ccccc3Br)nn1)CC2 ZINC000329733338 565678184 /nfs/dbraw/zinc/67/81/84/565678184.db2.gz QTUAFFAZEHABOI-KSSFIOAISA-N 1 1 391.313 3.157 10 0 GGAEMO O[C@]12CCCC[C@H]1C[N@@H+](Cc1cn(-c3ccccc3Br)nn1)CC2 ZINC000329733338 565678187 /nfs/dbraw/zinc/67/81/87/565678187.db2.gz QTUAFFAZEHABOI-KSSFIOAISA-N 1 1 391.313 3.157 10 0 GGAEMO Nc1c(Cl)cc(NC(=O)N2CCCC[C@H]2C[NH+]2CCOCC2)cc1Cl ZINC000192297774 565678415 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3.317 10 0 GGAEMO C[C@@H]1C[C@H](N(C)C(=O)N[C@@H]2C[C@H]2c2ccccc2Br)CC[N@H+]1C ZINC000280743186 565692028 /nfs/dbraw/zinc/69/20/28/565692028.db2.gz PGFAGVJVWWKAHD-LNCBFAARSA-N 1 1 380.330 3.429 10 0 GGAEMO CC[C@@H]1C[N@@H+](C[C@H](O)COc2c(Cl)cccc2Cl)C[C@@]2(CCOC2)O1 ZINC000330083012 565692187 /nfs/dbraw/zinc/69/21/87/565692187.db2.gz BEZAHNRFVXMCCA-PMUMKWKESA-N 1 1 390.307 3.003 10 0 GGAEMO C[C@@H]1C[N@@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C[C@@]2(CCCOC2)O1 ZINC000330100332 565692338 /nfs/dbraw/zinc/69/23/38/565692338.db2.gz DVDQAUWWXZQLNK-QIIPPGSGSA-N 1 1 390.307 3.003 10 0 GGAEMO C[C@@H]1C[C@@H](N(C)C(=O)N[C@@H]2C[C@H]2c2ccccc2Br)CC[N@H+]1C ZINC000280743188 565692917 /nfs/dbraw/zinc/69/29/17/565692917.db2.gz PGFAGVJVWWKAHD-RPCCPQHDSA-N 1 1 380.330 3.429 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CN(C)Cc1nc(-c2ccc(Br)s2)no1 ZINC000175339260 565693668 /nfs/dbraw/zinc/69/36/68/565693668.db2.gz OFWDQERFRCUMJF-NSHDSACASA-N 1 1 385.331 3.477 10 0 GGAEMO OC[C@H]([NH2+]C[C@@H](O)C(F)(F)F)c1ccc(Br)cc1C(F)(F)F ZINC000280774360 565694967 /nfs/dbraw/zinc/69/49/67/565694967.db2.gz PLLVHSYPPXLABA-VHSXEESVSA-N 1 1 396.125 3.014 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CN(C)Cc1nc(Cc2cccc(Br)c2)no1 ZINC000175351794 565695275 /nfs/dbraw/zinc/69/52/75/565695275.db2.gz ROWBATPAFHUQSC-MRXNPFEDSA-N 1 1 393.329 3.339 10 0 GGAEMO Cc1c(C(=O)NC2CC[NH+](Cc3ccc(Br)cc3)CC2)ccn1C ZINC000192531483 565698220 /nfs/dbraw/zinc/69/82/20/565698220.db2.gz SQSUKVSZSONBBQ-UHFFFAOYSA-N 1 1 390.325 3.490 10 0 GGAEMO C[N@H+]1CC[C@@H](NS(=O)(=O)Cc2ccc(Cl)c(F)c2)[C@@H]1c1ccccc1 ZINC000192817949 565712387 /nfs/dbraw/zinc/71/23/87/565712387.db2.gz XJSQZEDWIKEDPF-MSOLQXFVSA-N 1 1 382.888 3.344 10 0 GGAEMO C[C@H](NC(=O)N1C[C@@H](C)[C@@H]([NH+]2CCOCC2)C1)c1ccc(Cl)cc1Cl ZINC000175618504 565712577 /nfs/dbraw/zinc/71/25/77/565712577.db2.gz CLFFDIMMPYSZGP-IGCXYCKISA-N 1 1 386.323 3.417 10 0 GGAEMO Cc1cc(S(=O)(=O)N2CC[C@H](C[N@H+](C)Cc3scnc3C)C2)c(C)s1 ZINC000192935036 565719450 /nfs/dbraw/zinc/71/94/50/565719450.db2.gz 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ZINC000175866014 565729414 /nfs/dbraw/zinc/72/94/14/565729414.db2.gz JDKWOSQVYSTJOY-GFCCVEGCSA-N 1 1 383.315 3.390 10 0 GGAEMO CCC(=O)N1CCCC[C@H]1C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000330948440 565731466 /nfs/dbraw/zinc/73/14/66/565731466.db2.gz MRAHHJMZHNUPSH-INIZCTEOSA-N 1 1 396.329 3.240 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)NCc1cc(F)cc(Br)c1 ZINC000175947218 565735481 /nfs/dbraw/zinc/73/54/81/565735481.db2.gz VQYYFPYCDDWSEJ-INIZCTEOSA-N 1 1 395.276 3.467 10 0 GGAEMO O=C(CSc1n[nH]c(=S)s1)NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000175945357 565735523 /nfs/dbraw/zinc/73/55/23/565735523.db2.gz LTXLIVJZYPJDBL-UHFFFAOYSA-N 1 1 380.564 3.205 10 0 GGAEMO C[C@H](CNC(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1)Oc1ccccc1Br ZINC000175975764 565738229 /nfs/dbraw/zinc/73/82/29/565738229.db2.gz NWFJYSOMKJAKIX-RRFJBIMHSA-N 1 1 398.345 3.341 10 0 GGAEMO COC(=O)C[C@](C)([NH2+]Cc1ccc(Br)cn1)c1cccc(OC)c1 ZINC000411615223 565739764 /nfs/dbraw/zinc/73/97/64/565739764.db2.gz RMUWIOJDTYLLLB-SFHVURJKSA-N 1 1 393.281 3.421 10 0 GGAEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)NCc1ccccc1Br ZINC000176029802 565742731 /nfs/dbraw/zinc/74/27/31/565742731.db2.gz MYRPQOVKLKAJAP-HNNXBMFYSA-N 1 1 377.286 3.328 10 0 GGAEMO C[C@H](C(=O)NC[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1)N(C)CC(F)(F)F ZINC000193343125 565746086 /nfs/dbraw/zinc/74/60/86/565746086.db2.gz XPWXTVMAYSDLHP-IPYPFGDCSA-N 1 1 377.476 3.130 10 0 GGAEMO CCOc1ccc(NC(=O)CC[NH2+][C@H](C)c2ncc(Br)cn2)cc1 ZINC000411753587 565750327 /nfs/dbraw/zinc/75/03/27/565750327.db2.gz FYYCFWDGONZZRP-GFCCVEGCSA-N 1 1 393.285 3.317 10 0 GGAEMO C[C@@H]([NH2+]CCC(=O)NCc1ccccc1Cl)c1ncc(Br)cn1 ZINC000411758149 565750454 /nfs/dbraw/zinc/75/04/54/565750454.db2.gz NLUXKUOFTHTBKQ-LLVKDONJSA-N 1 1 397.704 3.250 10 0 GGAEMO O=C1NC(=O)[C@]2(CCC[N@H+](Cc3ccc(-c4ccccc4Cl)s3)C2)N1 ZINC000193464752 565754385 /nfs/dbraw/zinc/75/43/85/565754385.db2.gz DCQSFULXRQHBDB-GOSISDBHSA-N 1 1 375.881 3.243 10 0 GGAEMO C[NH+](C)CCN(Cc1ccco1)C(=O)c1[nH]nc2ccc(Br)cc21 ZINC000176171507 565754618 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COC(=O)[C@@H]1CSCC[N@@H+](CCC(=O)Nc2c(Cl)cccc2Cl)C1 ZINC000412080749 565769655 /nfs/dbraw/zinc/76/96/55/565769655.db2.gz QGIBKFZNPPFGDC-NSHDSACASA-N 1 1 391.320 3.160 10 0 GGAEMO CC(C)[N@H+](CC(=O)N[C@H](C)c1ccc(Cl)cc1Cl)C[C@H]1CCC(=O)N1 ZINC000412095603 565771301 /nfs/dbraw/zinc/77/13/01/565771301.db2.gz YAJRBCOGUNDIIJ-TZMCWYRMSA-N 1 1 386.323 3.160 10 0 GGAEMO COC(=O)[C@H]1CSCC[N@H+](Cc2csc(-c3cccc(OC)c3)n2)C1 ZINC000412101848 565771371 /nfs/dbraw/zinc/77/13/71/565771371.db2.gz XHEJPIHEUVDNSE-CQSZACIVSA-N 1 1 378.519 3.157 10 0 GGAEMO COC(=O)[C@H]1CSCC[N@@H+](Cc2csc(-c3cccc(OC)c3)n2)C1 ZINC000412101848 565771376 /nfs/dbraw/zinc/77/13/76/565771376.db2.gz XHEJPIHEUVDNSE-CQSZACIVSA-N 1 1 378.519 3.157 10 0 GGAEMO COC(=O)[C@@]1(C)CCC[N@@H+](C[C@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000412111385 565771504 /nfs/dbraw/zinc/77/15/04/565771504.db2.gz VWPLUUQCIIWJQS-SJCJKPOMSA-N 1 1 376.280 3.008 10 0 GGAEMO Cc1ncsc1C[N@H+](C)C[C@H]1CCN(C(=O)c2nnc(C(C)C)s2)C1 ZINC000282418619 565778153 /nfs/dbraw/zinc/77/81/53/565778153.db2.gz LPOCSYAVQWYLJL-CYBMUJFWSA-N 1 1 379.555 3.021 10 0 GGAEMO C[C@@H]1C[N@@H+](C)CC[C@@H]1N(C)C(=O)N[C@H]1CCOc2c(Br)cccc21 ZINC000282497984 565782344 /nfs/dbraw/zinc/78/23/44/565782344.db2.gz OPFGKTMKQNPZLD-KCXAZCMYSA-N 1 1 396.329 3.254 10 0 GGAEMO COCCCn1nccc1C[NH2+][C@H]1CCOc2c(Br)cccc21 ZINC000282524932 565783666 /nfs/dbraw/zinc/78/36/66/565783666.db2.gz ANFZDXFKLQGMIM-INIZCTEOSA-N 1 1 380.286 3.296 10 0 GGAEMO C[C@@H](C[NH2+]Cc1c(Cl)cccc1S(C)(=O)=O)N(C)C(=O)OC(C)(C)C ZINC000282631355 565789591 /nfs/dbraw/zinc/78/95/91/565789591.db2.gz GGYRZYLZXOZJKT-LBPRGKRZSA-N 1 1 390.933 3.089 10 0 GGAEMO CS(=O)(=O)N1CCC[C@H](C[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)C1 ZINC000176624004 565789868 /nfs/dbraw/zinc/78/98/68/565789868.db2.gz DRRRQPXORHBYNR-GDBMZVCRSA-N 1 1 379.551 3.105 10 0 GGAEMO CS(=O)(=O)N1CCC[C@@H](C[N@H+]2CCC[C@@H]2c2nc3ccccc3s2)C1 ZINC000176624023 565789950 /nfs/dbraw/zinc/78/99/50/565789950.db2.gz DRRRQPXORHBYNR-GOEBONIOSA-N 1 1 379.551 3.105 10 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GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(Br)c3c(c2)OCCO3)[C@@H](C)C1 ZINC000247523145 566062626 /nfs/dbraw/zinc/06/26/26/566062626.db2.gz WOJJBKBAANAKTF-SWLSCSKDSA-N 1 1 397.313 3.023 10 0 GGAEMO O=C(c1ccc(Br)cc1C(F)(F)F)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000180449186 566062652 /nfs/dbraw/zinc/06/26/52/566062652.db2.gz HWXMBHYPMUNJIB-LLVKDONJSA-N 1 1 377.204 3.388 10 0 GGAEMO CCOCC[N@@H+]1CCN([C@H](C)C(=O)Nc2ccc(Cl)cc2Cl)C[C@@H]1C ZINC000247561481 566062902 /nfs/dbraw/zinc/06/29/02/566062902.db2.gz GBGNAQQONLCGEV-UONOGXRCSA-N 1 1 388.339 3.363 10 0 GGAEMO CCOCC[N@H+]1CCN([C@H](C)C(=O)Nc2ccc(Cl)cc2Cl)C[C@@H]1C ZINC000247561481 566062907 /nfs/dbraw/zinc/06/29/07/566062907.db2.gz GBGNAQQONLCGEV-UONOGXRCSA-N 1 1 388.339 3.363 10 0 GGAEMO Cc1cc(C(=O)N2CC[N@H+]3CCC[C@@H]3C2)nn1-c1ccc(Cl)cc1Cl ZINC000180449309 566063113 /nfs/dbraw/zinc/06/31/13/566063113.db2.gz QPXSKAUQVPZLOW-CQSZACIVSA-N 1 1 379.291 3.408 10 0 GGAEMO COc1ccc(CCC(=O)N[C@@H]2C[N@H+](C(C)C)C[C@H]2C)cc1Br ZINC000247512524 566063149 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388.339 3.363 10 0 GGAEMO C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)[N@@H+]1CCC[C@@H](Cn2cncn2)C1 ZINC000247807405 566066499 /nfs/dbraw/zinc/06/64/99/566066499.db2.gz TUEBJVFSHOMWTO-CHWSQXEVSA-N 1 1 382.295 3.324 10 0 GGAEMO C[C@H](C(=O)Nc1ccc(Cl)cc1Cl)[N@H+]1CCC[C@@H](Cn2cncn2)C1 ZINC000247807405 566066504 /nfs/dbraw/zinc/06/65/04/566066504.db2.gz TUEBJVFSHOMWTO-CHWSQXEVSA-N 1 1 382.295 3.324 10 0 GGAEMO CC[C@@H]1CN(CCC(=O)Nc2cc(Cl)ccc2Cl)CC[N@H+]1C[C@H](C)O ZINC000247806776 566066800 /nfs/dbraw/zinc/06/68/00/566066800.db2.gz SVWNYZDULMDBGR-DZGCQCFKSA-N 1 1 388.339 3.099 10 0 GGAEMO CC[C@@H]1C[N@H+](CCC(=O)Nc2cc(Cl)ccc2Cl)CCN1C[C@H](C)O ZINC000247806776 566066805 /nfs/dbraw/zinc/06/68/05/566066805.db2.gz SVWNYZDULMDBGR-DZGCQCFKSA-N 1 1 388.339 3.099 10 0 GGAEMO CC[C@@H]1C[N@@H+](CCC(=O)Nc2cc(Cl)ccc2Cl)CCN1C[C@H](C)O ZINC000247806776 566066810 /nfs/dbraw/zinc/06/68/10/566066810.db2.gz SVWNYZDULMDBGR-DZGCQCFKSA-N 1 1 388.339 3.099 10 0 GGAEMO CC[C@H]1CN(CCC(=O)Nc2cc(Cl)ccc2Cl)CC[N@H+]1C[C@H](C)O 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O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1csc(I)c1 ZINC000600469635 566340562 /nfs/dbraw/zinc/34/05/62/566340562.db2.gz CVTJEEYKDALSIP-LBPRGKRZSA-N 1 1 390.290 3.099 10 0 GGAEMO CCc1nc(C[NH+]2CCC(CNC(=O)C3(C(F)(F)F)CC3)CC2)cs1 ZINC000600473565 566340596 /nfs/dbraw/zinc/34/05/96/566340596.db2.gz KILZHRRVVHUGDO-UHFFFAOYSA-N 1 1 375.460 3.376 10 0 GGAEMO O=C(CSCC(=O)c1ccc(Cl)cc1)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000600472693 566340811 /nfs/dbraw/zinc/34/08/11/566340811.db2.gz OJBQUDSWMHSHTA-KRWDZBQOSA-N 1 1 380.941 3.389 10 0 GGAEMO C[C@@H]([NH2+]CC(=O)N1CCC[C@@H](C(F)(F)F)C1)c1ccc(Br)cn1 ZINC000482953235 566343976 /nfs/dbraw/zinc/34/39/76/566343976.db2.gz BIPYRZCMNJNJLR-GHMZBOCLSA-N 1 1 394.235 3.296 10 0 GGAEMO C[N@H+]1C[C@@H](CNC(=O)Cc2ccccc2Br)[C@H](c2ccccc2)C1 ZINC000649101893 566344480 /nfs/dbraw/zinc/34/44/80/566344480.db2.gz LHIIESAVGRGOOH-MSOLQXFVSA-N 1 1 387.321 3.453 10 0 GGAEMO CNS(=O)(=O)[C@H]1CCC[N@H+](C/C(C)=C/c2cccc(C(F)(F)F)c2)C1 ZINC000576433148 566344959 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C[C@H]([NH2+]CC(=O)Nc1nc2c(s1)CCC2)c1ccc(Br)cn1 ZINC000482977974 566348908 /nfs/dbraw/zinc/34/89/08/566348908.db2.gz JXFCXTXKCXBTLO-VIFPVBQESA-N 1 1 381.299 3.079 10 0 GGAEMO C[C@@H]([NH2+]CC(=O)Nc1nc2c(s1)CCC2)c1ccc(Br)cn1 ZINC000482977972 566348935 /nfs/dbraw/zinc/34/89/35/566348935.db2.gz JXFCXTXKCXBTLO-SECBINFHSA-N 1 1 381.299 3.079 10 0 GGAEMO CCn1c(-c2ccccc2Br)nnc1N1CC[N@@H+](CC)[C@H](C)C1 ZINC000670110893 566349927 /nfs/dbraw/zinc/34/99/27/566349927.db2.gz RAAGBZMXLISCAN-CYBMUJFWSA-N 1 1 378.318 3.258 10 0 GGAEMO Cc1cc(Br)cc(C)c1NC(=O)CCC[N@H+]1CC[C@@](F)(CO)C1 ZINC000670111265 566350094 /nfs/dbraw/zinc/35/00/94/566350094.db2.gz JUTWWULOPPLILP-KRWDZBQOSA-N 1 1 387.293 3.191 10 0 GGAEMO COC(=O)[C@@H](NC[C@H]1CC[N@H+]1C1CCCC1)c1ccccc1Br ZINC000600614147 566350304 /nfs/dbraw/zinc/35/03/04/566350304.db2.gz MCGLDPJNJBBIQZ-PBHICJAKSA-N 1 1 381.314 3.270 10 0 GGAEMO C[C@H]1CCCC[N@H+]1CCNS(=O)(=O)c1c(Cl)cccc1Br ZINC000509943589 566350706 /nfs/dbraw/zinc/35/07/06/566350706.db2.gz 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C[C@H](NC(=O)c1ccc2scc(Br)c2c1)[C@H]1C[N@@H+](C)CCO1 ZINC000649200458 566354533 /nfs/dbraw/zinc/35/45/33/566354533.db2.gz RRKXSPZXCIRSMA-IINYFYTJSA-N 1 1 383.311 3.113 10 0 GGAEMO CC(C)([NH2+]CCNS(=O)(=O)c1ccccc1)c1nc2ccccc2s1 ZINC000625721173 566354700 /nfs/dbraw/zinc/35/47/00/566354700.db2.gz SOLWWNHQWQHTHS-UHFFFAOYSA-N 1 1 375.519 3.100 10 0 GGAEMO CCn1c(CNC(=O)[C@@H]2CCCC[N@H+]2CC)nc2cc(Br)ccc21 ZINC000483053011 566355892 /nfs/dbraw/zinc/35/58/92/566355892.db2.gz VEFHDTVKQWRNAG-INIZCTEOSA-N 1 1 393.329 3.309 10 0 GGAEMO FC(F)(F)c1cc(Br)cnc1N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000649224965 566356111 /nfs/dbraw/zinc/35/61/11/566356111.db2.gz HDUMDKKDHRYGAA-GFCCVEGCSA-N 1 1 394.235 3.164 10 0 GGAEMO COc1cc(CNC(=O)CC[C@@H]2CCCC[N@H+]2C)c(Br)cc1O ZINC000649238954 566356306 /nfs/dbraw/zinc/35/63/06/566356306.db2.gz QLPGZBJHGUABIM-ZDUSSCGKSA-N 1 1 385.302 3.044 10 0 GGAEMO CCn1c(CNC(=O)C[N@@H+]2[C@H](C)CC[C@@H]2C)nc2cc(Br)ccc21 ZINC000483063553 566357338 /nfs/dbraw/zinc/35/73/38/566357338.db2.gz OEKUAOKENNYDPN-BETUJISGSA-N 1 1 393.329 3.308 10 0 GGAEMO C[N@H+]1CC[C@H](NS(=O)(=O)CCc2cccc(Cl)c2)[C@@H]1c1ccccc1 ZINC000510021036 566357687 /nfs/dbraw/zinc/35/76/87/566357687.db2.gz PRJCGARHEDZFJC-OALUTQOASA-N 1 1 378.925 3.247 10 0 GGAEMO O[C@H](COc1cc(F)cc(Br)c1)C[N@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000625777184 566357843 /nfs/dbraw/zinc/35/78/43/566357843.db2.gz BVZNZHVYUHJESH-IMJJTQAJSA-N 1 1 390.318 3.298 10 0 GGAEMO COc1cc(Br)ccc1[C@H]1CCC[N@H+]1CCCN1CCOCC1 ZINC000625795083 566358628 /nfs/dbraw/zinc/35/86/28/566358628.db2.gz QMTNVBULUHNLRB-QGZVFWFLSA-N 1 1 383.330 3.317 10 0 GGAEMO CC(C)(C)c1noc(C[NH2+][C@]2(CO)CCc3cc(Br)ccc3C2)n1 ZINC000625794256 566359072 /nfs/dbraw/zinc/35/90/72/566359072.db2.gz FJGDBAATLSRLNU-GOSISDBHSA-N 1 1 394.313 3.139 10 0 GGAEMO COc1ccc(CNC(=O)NCC[N@H+]2CCCC[C@@H]2C)cc1Br ZINC000510044215 566359333 /nfs/dbraw/zinc/35/93/33/566359333.db2.gz WFWVSXVFMSABOB-ZDUSSCGKSA-N 1 1 384.318 3.131 10 0 GGAEMO CC[C@H](CO)[NH+]1CCN(C(=O)CSc2cc(Cl)ccc2Cl)CC1 ZINC000536233463 566359721 /nfs/dbraw/zinc/35/97/21/566359721.db2.gz UVJPWXOYZUONDC-CYBMUJFWSA-N 1 1 377.337 3.001 10 0 GGAEMO O=C(N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1)C1(c2cccc(Br)c2)CC1 ZINC000670378378 566359895 /nfs/dbraw/zinc/35/98/95/566359895.db2.gz XWEBDIVBDGYEGX-HOTGVXAUSA-N 1 1 381.289 3.125 10 0 GGAEMO COc1cc(Br)ccc1[C@H]1CCCN1C[C@@H](O)C[N@@H+](C)C1CC1 ZINC000625794389 566360015 /nfs/dbraw/zinc/36/00/15/566360015.db2.gz JJCMKUZSPSNYMJ-DOTOQJQBSA-N 1 1 383.330 3.050 10 0 GGAEMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)C(=O)c2ccc(Br)cc2)C1 ZINC000510049648 566360366 /nfs/dbraw/zinc/36/03/66/566360366.db2.gz RNNHRUUCMOQQJV-OKILXGFUSA-N 1 1 381.314 3.116 10 0 GGAEMO CCn1cc(Br)cc1C(=O)N[C@H]1CC[N@@H+](C)[C@@H]1c1ccccc1 ZINC000536264822 566361856 /nfs/dbraw/zinc/36/18/56/566361856.db2.gz QJKLVAIUMPBMPH-DOTOQJQBSA-N 1 1 376.298 3.446 10 0 GGAEMO CNC(=O)[C@H]1CCC[N@@H+]1Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000510088782 566364173 /nfs/dbraw/zinc/36/41/73/566364173.db2.gz UPYUPJCTQDLFCR-CQSZACIVSA-N 1 1 380.311 3.283 10 0 GGAEMO CNC(=O)[C@H]1CCC[N@H+]1Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000510088782 566364176 /nfs/dbraw/zinc/36/41/76/566364176.db2.gz UPYUPJCTQDLFCR-CQSZACIVSA-N 1 1 380.311 3.283 10 0 GGAEMO Cc1ccc(C[N@@H+](CCO)CCC(=O)Nc2ccc(Br)cc2F)o1 ZINC000483198452 566364631 /nfs/dbraw/zinc/36/46/31/566364631.db2.gz MNAQWBVELYEPKI-UHFFFAOYSA-N 1 1 399.260 3.313 10 0 GGAEMO C[N@H+]1CCCC[C@@H]1CCC(=O)N[C@H]1COc2cc(F)c(Br)cc21 ZINC000510118557 566365187 /nfs/dbraw/zinc/36/51/87/566365187.db2.gz MSPJCCBQYVPTRE-ABAIWWIYSA-N 1 1 385.277 3.402 10 0 GGAEMO C[C@H](c1cccc(Br)c1)N1CCN(c2cc[nH+]c(N(C)C)n2)CC1 ZINC000483240686 566365672 /nfs/dbraw/zinc/36/56/72/566365672.db2.gz UPWGSEIHWXYUBA-CQSZACIVSA-N 1 1 390.329 3.188 10 0 GGAEMO Cc1c(Cl)c(C[NH2+]CCCNC(=O)c2cccc(Br)c2)nn1C ZINC000421329622 566366411 /nfs/dbraw/zinc/36/64/11/566366411.db2.gz WAHWVKHEFZQVIM-UHFFFAOYSA-N 1 1 399.720 3.054 10 0 GGAEMO C[C@@H](c1cccc(Br)c1)N1CCN(c2cc[nH+]c(N(C)C)n2)CC1 ZINC000483240684 566366560 /nfs/dbraw/zinc/36/65/60/566366560.db2.gz UPWGSEIHWXYUBA-AWEZNQCLSA-N 1 1 390.329 3.188 10 0 GGAEMO CNC(=O)[C@@H]1CC[N@@H+](Cc2cnc(-c3ccc(Br)cc3)s2)C1 ZINC000421373224 566368969 /nfs/dbraw/zinc/36/89/69/566368969.db2.gz DSEMMGVOTPNXGI-GFCCVEGCSA-N 1 1 380.311 3.141 10 0 GGAEMO C[NH+](C)[C@@H](CNC(=O)[C@@H]1CCOc2ccc(Br)cc21)c1ccco1 ZINC000649512904 566369538 /nfs/dbraw/zinc/36/95/38/566369538.db2.gz UEBMWHINBMOFKB-HIFRSBDPSA-N 1 1 393.281 3.327 10 0 GGAEMO C[C@@H]1OCC[C@@H]1[N@@H+](CCO)Cc1cc(Br)ccc1OC(F)F ZINC000483269252 566369629 /nfs/dbraw/zinc/36/96/29/566369629.db2.gz RHCPCFKSLDWXRF-GWCFXTLKSA-N 1 1 380.229 3.022 10 0 GGAEMO C[C@H]1OCC[C@@H]1[N@@H+](CCO)Cc1cc(Br)ccc1OC(F)F ZINC000483269258 566369745 /nfs/dbraw/zinc/36/97/45/566369745.db2.gz RHCPCFKSLDWXRF-MFKMUULPSA-N 1 1 380.229 3.022 10 0 GGAEMO C[NH+](C)[C@H](CNC(=O)[C@H]1CCOc2ccc(Br)cc21)c1ccco1 ZINC000649512903 566370170 /nfs/dbraw/zinc/37/01/70/566370170.db2.gz UEBMWHINBMOFKB-DZGCQCFKSA-N 1 1 393.281 3.327 10 0 GGAEMO C[C@H](N[C@H]1C[N@@H+](C2CC2)C[C@@H]1C)c1ccc(Br)cc1OCCCO ZINC000462951976 566370261 /nfs/dbraw/zinc/37/02/61/566370261.db2.gz HOIPLXUXUQMBAJ-DEYYWGMASA-N 1 1 397.357 3.344 10 0 GGAEMO C[C@H](N[C@H]1C[N@H+](C2CC2)C[C@@H]1C)c1ccc(Br)cc1OCCCO ZINC000462951976 566370262 /nfs/dbraw/zinc/37/02/62/566370262.db2.gz HOIPLXUXUQMBAJ-DEYYWGMASA-N 1 1 397.357 3.344 10 0 GGAEMO C[C@H](N[C@H]1C[N@@H+](C2CC2)C[C@H]1C)c1ccc(Br)cc1OCCCO ZINC000462951977 566370388 /nfs/dbraw/zinc/37/03/88/566370388.db2.gz HOIPLXUXUQMBAJ-GLJUWKHASA-N 1 1 397.357 3.344 10 0 GGAEMO C[C@H](N[C@H]1C[N@H+](C2CC2)C[C@H]1C)c1ccc(Br)cc1OCCCO ZINC000462951977 566370392 /nfs/dbraw/zinc/37/03/92/566370392.db2.gz HOIPLXUXUQMBAJ-GLJUWKHASA-N 1 1 397.357 3.344 10 0 GGAEMO C[C@@H]1OCC[C@H]1[N@H+](CCO)Cc1coc(-c2ccc(Br)cc2)n1 ZINC000483290990 566370450 /nfs/dbraw/zinc/37/04/50/566370450.db2.gz JAEZPKBHCSLUCV-BLLLJJGKSA-N 1 1 381.270 3.076 10 0 GGAEMO C[C@@H]1OCC[C@H]1[N@@H+](CCO)Cc1coc(-c2ccc(Br)cc2)n1 ZINC000483290990 566370460 /nfs/dbraw/zinc/37/04/60/566370460.db2.gz JAEZPKBHCSLUCV-BLLLJJGKSA-N 1 1 381.270 3.076 10 0 GGAEMO C[C@H]1OCC[C@@H]1[N@H+](CCO)CC(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000483294063 566370941 /nfs/dbraw/zinc/37/09/41/566370941.db2.gz HOEUHGLCENDWCM-OTYXRUKQSA-N 1 1 381.687 3.057 10 0 GGAEMO C[C@H]1OCC[C@@H]1[N@@H+](CCO)CC(=O)Nc1cc(Cl)c(Cl)cc1Cl ZINC000483294063 566370948 /nfs/dbraw/zinc/37/09/48/566370948.db2.gz HOEUHGLCENDWCM-OTYXRUKQSA-N 1 1 381.687 3.057 10 0 GGAEMO Cc1ccc(NCCCNC(=O)c2ccc(Br)c(F)c2F)[nH+]c1 ZINC000625978694 566372002 /nfs/dbraw/zinc/37/20/02/566372002.db2.gz BBSSEUHEASIWEL-UHFFFAOYSA-N 1 1 384.224 3.085 10 0 GGAEMO Cc1nc(C(C)(C)[NH2+]Cc2ccc(S(=O)(=O)NC3CC3)cc2)sc1C ZINC000649562506 566372879 /nfs/dbraw/zinc/37/28/79/566372879.db2.gz KXOUOHYKHUWPDM-UHFFFAOYSA-N 1 1 379.551 3.226 10 0 GGAEMO COCCOC[C@H](O)C[N@@H+]1CCC[C@H]1c1ccc(Br)cc1Cl ZINC000626009713 566373671 /nfs/dbraw/zinc/37/36/71/566373671.db2.gz QRQZRQZZEVYAEO-CJNGLKHVSA-N 1 1 392.721 3.263 10 0 GGAEMO COCCOC[C@H](O)C[N@H+]1CCC[C@H]1c1ccc(Br)cc1Cl ZINC000626009713 566373677 /nfs/dbraw/zinc/37/36/77/566373677.db2.gz QRQZRQZZEVYAEO-CJNGLKHVSA-N 1 1 392.721 3.263 10 0 GGAEMO C[N@H+](CC[C@H]1CCCCO1)Cc1cn(-c2cccc(Br)c2)nn1 ZINC000483349281 566374577 /nfs/dbraw/zinc/37/45/77/566374577.db2.gz CYNROZNJUOPNKZ-QGZVFWFLSA-N 1 1 379.302 3.421 10 0 GGAEMO C[N@@H+](CC[C@H]1CCCCO1)Cc1cn(-c2cccc(Br)c2)nn1 ZINC000483349281 566374583 /nfs/dbraw/zinc/37/45/83/566374583.db2.gz CYNROZNJUOPNKZ-QGZVFWFLSA-N 1 1 379.302 3.421 10 0 GGAEMO C[N@H+](CC[C@@H]1CCCCO1)Cc1cn(-c2cccc(Br)c2)nn1 ZINC000483349280 566374628 /nfs/dbraw/zinc/37/46/28/566374628.db2.gz CYNROZNJUOPNKZ-KRWDZBQOSA-N 1 1 379.302 3.421 10 0 GGAEMO C[N@@H+](CC[C@@H]1CCCCO1)Cc1cn(-c2cccc(Br)c2)nn1 ZINC000483349280 566374632 /nfs/dbraw/zinc/37/46/32/566374632.db2.gz CYNROZNJUOPNKZ-KRWDZBQOSA-N 1 1 379.302 3.421 10 0 GGAEMO O[C@H](Cn1cccn1)C[N@@H+]1CCC[C@H]1c1ccc(Br)cc1Cl ZINC000626008792 566375096 /nfs/dbraw/zinc/37/50/96/566375096.db2.gz LWYXFKMGZSIFBR-BBRMVZONSA-N 1 1 384.705 3.497 10 0 GGAEMO O[C@H](Cn1cccn1)C[N@H+]1CCC[C@H]1c1ccc(Br)cc1Cl ZINC000626008792 566375100 /nfs/dbraw/zinc/37/51/00/566375100.db2.gz LWYXFKMGZSIFBR-BBRMVZONSA-N 1 1 384.705 3.497 10 0 GGAEMO Cc1cc(Br)ccc1[C@H]1CCC[N@@H+]1CCCS(=O)(=O)N(C)C ZINC000626009223 566375148 /nfs/dbraw/zinc/37/51/48/566375148.db2.gz BKZPWRHSGSETBH-MRXNPFEDSA-N 1 1 389.359 3.176 10 0 GGAEMO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]Cc1cc(Cl)cc(S(N)(=O)=O)c1 ZINC000649587085 566375397 /nfs/dbraw/zinc/37/53/97/566375397.db2.gz ZYRMAGFSPMWTSP-LLVKDONJSA-N 1 1 384.933 3.098 10 0 GGAEMO CC1(C)CN(C(=O)c2ccc3scc(Br)c3c2)CC[N@@H+]1CCO ZINC000649582209 566375445 /nfs/dbraw/zinc/37/54/45/566375445.db2.gz FOAYMPYZBKHRQO-UHFFFAOYSA-N 1 1 397.338 3.193 10 0 GGAEMO CC1(C)CN(C(=O)c2ccc3scc(Br)c3c2)CC[N@H+]1CCO ZINC000649582209 566375450 /nfs/dbraw/zinc/37/54/50/566375450.db2.gz FOAYMPYZBKHRQO-UHFFFAOYSA-N 1 1 397.338 3.193 10 0 GGAEMO COC[C@H](C)OC[C@@H](O)C[N@H+]1CCC[C@@H]1c1ccc(Br)cc1C ZINC000626010039 566376073 /nfs/dbraw/zinc/37/60/73/566376073.db2.gz CLNQOVOETNTDED-QILLFSRXSA-N 1 1 386.330 3.307 10 0 GGAEMO C[C@H](CNC(=O)c1nscc1Br)[N@H+]1CCc2ccccc2C1 ZINC000649598741 566376427 /nfs/dbraw/zinc/37/64/27/566376427.db2.gz VKPRKECDMJWODM-LLVKDONJSA-N 1 1 380.311 3.082 10 0 GGAEMO CCS(=O)(=O)NCCC[N@H+]1CCC[C@H]1c1ccc(Br)cc1C ZINC000626010619 566376746 /nfs/dbraw/zinc/37/67/46/566376746.db2.gz YRBOEFGTZYQUIX-INIZCTEOSA-N 1 1 389.359 3.224 10 0 GGAEMO CC1(C)[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc(S(=O)(=O)NC2CC2)cc1 ZINC000649592102 566376913 /nfs/dbraw/zinc/37/69/13/566376913.db2.gz UQLPTZSZYSQHEZ-HNNXBMFYSA-N 1 1 376.444 3.290 10 0 GGAEMO CC[C@@H](CNC(=O)c1nscc1Br)[N@H+]1CCc2ccccc2C1 ZINC000649602257 566377083 /nfs/dbraw/zinc/37/70/83/566377083.db2.gz USEKLMLXARBLCJ-AWEZNQCLSA-N 1 1 394.338 3.472 10 0 GGAEMO CCOC(=O)COCC[N@@H+](C)[C@@H]1CCSc2ccc(Br)cc21 ZINC000576791506 566377440 /nfs/dbraw/zinc/37/74/40/566377440.db2.gz CFVMVZXWCSKCPW-CQSZACIVSA-N 1 1 388.327 3.498 10 0 GGAEMO C[C@@H]1C[C@H](c2ccc(Br)cc2)C[N@H+]1CCN1C[C@H]2CC[C@@H](C1)O2 ZINC000626041303 566377821 /nfs/dbraw/zinc/37/78/21/566377821.db2.gz UUEDOIOBXGYKQT-HYEGPXJVSA-N 1 1 379.342 3.490 10 0 GGAEMO Cc1cc(NC(=O)C[N@@H+]2C[C@H](c3ccc(Br)cc3)C[C@H]2C)n(C)n1 ZINC000626039888 566377908 /nfs/dbraw/zinc/37/79/08/566377908.db2.gz RGWMKINTFLPHOD-UKRRQHHQSA-N 1 1 391.313 3.308 10 0 GGAEMO C[C@@H]1C[C@H](c2ccc(Br)cc2)C[N@H+]1C[C@@H](O)COC[C@@H]1CCCO1 ZINC000626040173 566378076 /nfs/dbraw/zinc/37/80/76/566378076.db2.gz YPWKJTAQKWUXJO-HYEGPXJVSA-N 1 1 398.341 3.183 10 0 GGAEMO C[C@@H]1C[C@@H](c2ccc(Br)cc2)C[N@H+]1C[C@@H](O)COC1CCOCC1 ZINC000626040779 566378458 /nfs/dbraw/zinc/37/84/58/566378458.db2.gz LWXRCOMQMRTTCE-QGPMSJSTSA-N 1 1 398.341 3.183 10 0 GGAEMO C[NH+](C)C1(CNC(=O)c2n[nH]c3ccc(Br)cc32)CCCCC1 ZINC000600925884 566378466 /nfs/dbraw/zinc/37/84/66/566378466.db2.gz ZWLMBEBWJZZIIS-UHFFFAOYSA-N 1 1 379.302 3.320 10 0 GGAEMO COCCc1nc(C[N@@H+]2C[C@H](c3ccc(Br)cc3)C[C@H]2C)no1 ZINC000626041285 566378533 /nfs/dbraw/zinc/37/85/33/566378533.db2.gz UFCXYLYRXIUJGC-TZMCWYRMSA-N 1 1 380.286 3.399 10 0 GGAEMO COCCc1nc(C[N@H+]2C[C@H](c3ccc(Br)cc3)C[C@H]2C)no1 ZINC000626041285 566378536 /nfs/dbraw/zinc/37/85/36/566378536.db2.gz UFCXYLYRXIUJGC-TZMCWYRMSA-N 1 1 380.286 3.399 10 0 GGAEMO C[C@@H]1C[C@@H](c2ccc(Br)cc2)C[N@H+]1Cc1cc(=O)n2nccc2[nH]1 ZINC000626040729 566378671 /nfs/dbraw/zinc/37/86/71/566378671.db2.gz KVLCFIYLSAWGGT-TZMCWYRMSA-N 1 1 387.281 3.163 10 0 GGAEMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)[C@@H]1CCOc2ccc(Br)cc21 ZINC000649616498 566378736 /nfs/dbraw/zinc/37/87/36/566378736.db2.gz KGJHTJYDPYLWOK-FVQBIDKESA-N 1 1 379.298 3.058 10 0 GGAEMO C[C@@H]1C[C@H](c2ccc(Br)cc2)C[N@H+]1C[C@@H](O)COC1CCOCC1 ZINC000626040780 566378742 /nfs/dbraw/zinc/37/87/42/566378742.db2.gz LWXRCOMQMRTTCE-UWWQBHOKSA-N 1 1 398.341 3.183 10 0 GGAEMO C[C@@H]1C[C@H](c2ccc(Br)cc2)C[N@H+]1CC[C@H]1CCS(=O)(=O)C1 ZINC000626041002 566378848 /nfs/dbraw/zinc/37/88/48/566378848.db2.gz PHNFSOCKEDICML-YCPHGPKFSA-N 1 1 386.355 3.452 10 0 GGAEMO Ic1cccc(OCCC[N@H+]2CC[C@H](n3cccn3)C2)c1 ZINC000463034260 566378887 /nfs/dbraw/zinc/37/88/87/566378887.db2.gz MRSVSBBSRALROT-HNNXBMFYSA-N 1 1 397.260 3.204 10 0 GGAEMO Cc1cc(NC(=O)C[N@@H+]2C[C@@H](c3ccc(Br)cc3)C[C@@H]2C)n(C)n1 ZINC000626039889 566378925 /nfs/dbraw/zinc/37/89/25/566378925.db2.gz RGWMKINTFLPHOD-ZFWWWQNUSA-N 1 1 391.313 3.308 10 0 GGAEMO COCCc1nc(C[N@@H+]2C[C@H](c3ccc(Br)cc3)C[C@@H]2C)no1 ZINC000626041282 566379036 /nfs/dbraw/zinc/37/90/36/566379036.db2.gz UFCXYLYRXIUJGC-GXTWGEPZSA-N 1 1 380.286 3.399 10 0 GGAEMO COCCc1nc(C[N@H+]2C[C@H](c3ccc(Br)cc3)C[C@@H]2C)no1 ZINC000626041282 566379040 /nfs/dbraw/zinc/37/90/40/566379040.db2.gz UFCXYLYRXIUJGC-GXTWGEPZSA-N 1 1 380.286 3.399 10 0 GGAEMO C[C@@H]1C[C@H](c2ccc(Br)cc2)C[N@@H+]1CC(=O)Nc1cnccn1 ZINC000626040504 566379073 /nfs/dbraw/zinc/37/90/73/566379073.db2.gz GTFFDOPHHGCRLB-OCCSQVGLSA-N 1 1 375.270 3.056 10 0 GGAEMO C[C@@H]1C[C@H](c2ccc(Br)cc2)C[N@H+]1CC(=O)Nc1cnccn1 ZINC000626040504 566379078 /nfs/dbraw/zinc/37/90/78/566379078.db2.gz GTFFDOPHHGCRLB-OCCSQVGLSA-N 1 1 375.270 3.056 10 0 GGAEMO C[C@@H]1C[C@H](c2ccc(Br)cc2)C[N@H+]1C[C@H]1CCCS(=O)(=O)C1 ZINC000626041333 566380060 /nfs/dbraw/zinc/38/00/60/566380060.db2.gz VRIPBHBCYSMMSY-FMKPAKJESA-N 1 1 386.355 3.452 10 0 GGAEMO C[C@@H]1C[C@@H](c2ccc(Br)cc2)C[N@H+]1C[C@@H]1CCCS(=O)(=O)C1 ZINC000626041335 566380376 /nfs/dbraw/zinc/38/03/76/566380376.db2.gz VRIPBHBCYSMMSY-IJEWVQPXSA-N 1 1 386.355 3.452 10 0 GGAEMO C[C@H](c1ccccc1)[N@H+]1CC[C@@H](NC(=O)c2nscc2Br)C1 ZINC000649640999 566380496 /nfs/dbraw/zinc/38/04/96/566380496.db2.gz XHMVHBWXWQAEMS-DGCLKSJQSA-N 1 1 380.311 3.471 10 0 GGAEMO C[C@@H]1C[C@@H](c2ccc(Br)cc2)C[N@H+]1CCN1C[C@H]2CC[C@@H](C1)O2 ZINC000626041304 566381633 /nfs/dbraw/zinc/38/16/33/566381633.db2.gz UUEDOIOBXGYKQT-OPNNQBFTSA-N 1 1 379.342 3.490 10 0 GGAEMO CN(CC(F)(F)F)C(=O)C[NH2+]C1(c2ccccc2Br)CCC1 ZINC000649646884 566381686 /nfs/dbraw/zinc/38/16/86/566381686.db2.gz VCKQEAYHYZUWLT-UHFFFAOYSA-N 1 1 379.220 3.439 10 0 GGAEMO CNC(=O)C[C@@H]([NH2+]CC(=O)Nc1cc(Cl)ccc1Cl)c1ccccc1 ZINC000483414798 566381934 /nfs/dbraw/zinc/38/19/34/566381934.db2.gz ILBJZRCCHSASPD-OAHLLOKOSA-N 1 1 380.275 3.399 10 0 GGAEMO O=C(C[NH2+]C1(c2ccccc2Br)CCC1)N1CCOC[C@@H]1C1CC1 ZINC000649647011 566381930 /nfs/dbraw/zinc/38/19/30/566381930.db2.gz YZKOCNKYZGFAND-QGZVFWFLSA-N 1 1 393.325 3.055 10 0 GGAEMO C[C@H]1CN(C(=O)C[NH2+]C2(c3ccccc3Br)CCC2)C[C@H](C)O1 ZINC000649645874 566382218 /nfs/dbraw/zinc/38/22/18/566382218.db2.gz LMVHTLGUEKRIJE-KBPBESRZSA-N 1 1 381.314 3.054 10 0 GGAEMO C[C@H](NC(=O)CN1CC[NH+](CCCF)CC1)c1ccc(Cl)c(Cl)c1 ZINC000626073325 566382341 /nfs/dbraw/zinc/38/23/41/566382341.db2.gz GRJSGPSNHWSHIX-ZDUSSCGKSA-N 1 1 376.303 3.148 10 0 GGAEMO O=C(CN1CC[NH+](CCCF)CC1)Nc1ccc(Cl)cc1C(F)(F)F ZINC000626071804 566382903 /nfs/dbraw/zinc/38/29/03/566382903.db2.gz UZMIQJJWGRGPIO-UHFFFAOYSA-N 1 1 381.801 3.275 10 0 GGAEMO CNC(=O)C[C@@H]([NH2+]Cc1nc2cc(Br)ccc2[nH]1)c1ccccc1 ZINC000483416947 566383053 /nfs/dbraw/zinc/38/30/53/566383053.db2.gz XGIYUQCBZGVERC-OAHLLOKOSA-N 1 1 387.281 3.292 10 0 GGAEMO CC(C)C[N@H+]1CC[C@H](CNC(=O)[C@H]2[C@@H]3c4cccc(Br)c4C[C@H]23)C1 ZINC000626069397 566383335 /nfs/dbraw/zinc/38/33/35/566383335.db2.gz QTNYJWINWCQSRL-ZFKCKOODSA-N 1 1 391.353 3.429 10 0 GGAEMO OC1(C2CC[NH+](Cc3nnc(-c4ccccc4Br)o3)CC2)CC1 ZINC000649675700 566384100 /nfs/dbraw/zinc/38/41/00/566384100.db2.gz GPYUCDKXEAUCTE-UHFFFAOYSA-N 1 1 378.270 3.236 10 0 GGAEMO C[C@@]1(c2cccc(F)c2)CC[N@H+](Cc2cc(Cl)cc(S(N)(=O)=O)c2)C1 ZINC000649662340 566384276 /nfs/dbraw/zinc/38/42/76/566384276.db2.gz AQMFJWQBBNWQCG-GOSISDBHSA-N 1 1 382.888 3.290 10 0 GGAEMO C[C@@]1(c2cccc(F)c2)CC[N@@H+](Cc2cc(Cl)cc(S(N)(=O)=O)c2)C1 ZINC000649662340 566384283 /nfs/dbraw/zinc/38/42/83/566384283.db2.gz AQMFJWQBBNWQCG-GOSISDBHSA-N 1 1 382.888 3.290 10 0 GGAEMO Brc1ccc2nc(C[N@@H+]3CCCC[C@H]3CN3CCOCC3)oc2c1 ZINC000463092871 566384482 /nfs/dbraw/zinc/38/44/82/566384482.db2.gz MYJKNVVKGOKITK-HNNXBMFYSA-N 1 1 394.313 3.277 10 0 GGAEMO Brc1ccc2nc(C[N@H+]3CCCC[C@H]3CN3CCOCC3)oc2c1 ZINC000463092871 566384492 /nfs/dbraw/zinc/38/44/92/566384492.db2.gz MYJKNVVKGOKITK-HNNXBMFYSA-N 1 1 394.313 3.277 10 0 GGAEMO CCS(=O)(=O)NCC[N@H+](Cc1cccs1)Cc1ccc2[nH]ccc2c1 ZINC000626112940 566385985 /nfs/dbraw/zinc/38/59/85/566385985.db2.gz WTLKGHGCUTUYQM-UHFFFAOYSA-N 1 1 377.535 3.171 10 0 GGAEMO C[C@@H](NC(=O)N[C@@H](C)Cc1ccc(Br)cc1)C1=CC[N@@H+](C)CC1 ZINC000510478192 566386064 /nfs/dbraw/zinc/38/60/64/566386064.db2.gz GCTHFUSRHHUGQM-UONOGXRCSA-N 1 1 380.330 3.330 10 0 GGAEMO CCS(=O)(=O)NCC[N@@H+](Cc1cccs1)Cc1ccc2[nH]ccc2c1 ZINC000626112940 566385997 /nfs/dbraw/zinc/38/59/97/566385997.db2.gz WTLKGHGCUTUYQM-UHFFFAOYSA-N 1 1 377.535 3.171 10 0 GGAEMO C[C@@H](C(=O)N1CCc2sccc2C1)[NH+]1CCC2(CC1)C(F)(F)C2(F)F ZINC000649710628 566387345 /nfs/dbraw/zinc/38/73/45/566387345.db2.gz ICCJMZUAWMZHAQ-NSHDSACASA-N 1 1 376.419 3.388 10 0 GGAEMO C[C@H](NC(=O)C(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1)c1cc(Cl)ccc1Cl ZINC000670925272 566388421 /nfs/dbraw/zinc/38/84/21/566388421.db2.gz NWJZYEZWEUTNCA-OBJOEFQTSA-N 1 1 386.323 3.112 10 0 GGAEMO COC[C@@H]1C[C@@H](O)C[N@@H+]1Cc1csc(-c2ccc(Br)cc2)n1 ZINC000649743026 566388933 /nfs/dbraw/zinc/38/89/33/566388933.db2.gz AWLOUPLYECEYBV-LSDHHAIUSA-N 1 1 383.311 3.154 10 0 GGAEMO COC[C@@H]1C[C@@H](O)C[N@H+]1Cc1csc(-c2ccc(Br)cc2)n1 ZINC000649743026 566388941 /nfs/dbraw/zinc/38/89/41/566388941.db2.gz AWLOUPLYECEYBV-LSDHHAIUSA-N 1 1 383.311 3.154 10 0 GGAEMO CN(C(=O)[C@@H]1CCOc2ccc(Br)cc21)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000649723349 566389341 /nfs/dbraw/zinc/38/93/41/566389341.db2.gz IJBTXHANJIIMGA-HUUCEWRRSA-N 1 1 379.298 3.010 10 0 GGAEMO Cc1noc([C@H]2OCC[C@H]2[NH2+][C@H](C)C(=O)Nc2ccc(Cl)cc2Cl)n1 ZINC000626144275 566389619 /nfs/dbraw/zinc/38/96/19/566389619.db2.gz AGQPELQSJYTPQU-WZYXQFPFSA-N 1 1 385.251 3.132 10 0 GGAEMO CSC1(CNCc2ncc(Br)cc2Cl)CC[NH+](C)CC1 ZINC000601125103 566391393 /nfs/dbraw/zinc/39/13/93/566391393.db2.gz LOQPVKBLDJABKU-UHFFFAOYSA-N 1 1 378.767 3.415 10 0 GGAEMO CNS(=O)(=O)C[C@H]1CCC[N@@H+](CCCSc2ccccc2Cl)C1 ZINC000626169757 566391617 /nfs/dbraw/zinc/39/16/17/566391617.db2.gz RJLWZCBJWOGTRO-AWEZNQCLSA-N 1 1 376.975 3.083 10 0 GGAEMO CC[N@H+](CC(=O)Nc1c(F)cc(F)cc1Br)[C@@H]1CCCOC1 ZINC000649757198 566391613 /nfs/dbraw/zinc/39/16/13/566391613.db2.gz HKFJJQUKWYMAHU-LLVKDONJSA-N 1 1 377.229 3.167 10 0 GGAEMO CC[N@@H+](CC(=O)Nc1c(F)cc(F)cc1Br)[C@@H]1CCCOC1 ZINC000649757198 566391619 /nfs/dbraw/zinc/39/16/19/566391619.db2.gz HKFJJQUKWYMAHU-LLVKDONJSA-N 1 1 377.229 3.167 10 0 GGAEMO COc1sc(C[N@@H+]2CCC[C@H](C(=O)N3CCCC3)C2)cc1Br ZINC000536671970 566392037 /nfs/dbraw/zinc/39/20/37/566392037.db2.gz WYKKOFJQOKILHJ-LBPRGKRZSA-N 1 1 387.343 3.354 10 0 GGAEMO COc1sc(C[N@H+]2CCC[C@H](C(=O)N3CCCC3)C2)cc1Br ZINC000536671970 566392042 /nfs/dbraw/zinc/39/20/42/566392042.db2.gz WYKKOFJQOKILHJ-LBPRGKRZSA-N 1 1 387.343 3.354 10 0 GGAEMO CNS(=O)(=O)C[C@@H]1CCC[N@@H+](CCCSc2ccccc2Cl)C1 ZINC000626169758 566392111 /nfs/dbraw/zinc/39/21/11/566392111.db2.gz RJLWZCBJWOGTRO-CQSZACIVSA-N 1 1 376.975 3.083 10 0 GGAEMO COC(=O)COc1cccc(C[NH2+]Cc2ncc(Br)cc2Cl)c1 ZINC000601109157 566392221 /nfs/dbraw/zinc/39/22/21/566392221.db2.gz SGJUFNMJKGESAF-UHFFFAOYSA-N 1 1 399.672 3.339 10 0 GGAEMO COC(=O)c1cc(Cl)cc(Cl)c1NC(=O)C[N@H+](C(C)C)[C@H]1CCOC1 ZINC000463217193 566392524 /nfs/dbraw/zinc/39/25/24/566392524.db2.gz BLGQUGIASPONDF-LBPRGKRZSA-N 1 1 389.279 3.218 10 0 GGAEMO COC(=O)c1cc(Cl)cc(Cl)c1NC(=O)C[N@@H+](C(C)C)[C@H]1CCOC1 ZINC000463217193 566392533 /nfs/dbraw/zinc/39/25/33/566392533.db2.gz BLGQUGIASPONDF-LBPRGKRZSA-N 1 1 389.279 3.218 10 0 GGAEMO CC(C)[N@@H+](C[C@H](O)COc1ccc(Cl)cc1Br)[C@H]1CCOC1 ZINC000463228588 566393550 /nfs/dbraw/zinc/39/35/50/566393550.db2.gz CULMLHBCWRYSLM-KBPBESRZSA-N 1 1 392.721 3.342 10 0 GGAEMO C[N@@H+](CCCOc1cccc(I)c1)CCc1cnccn1 ZINC000536707638 566396443 /nfs/dbraw/zinc/39/64/43/566396443.db2.gz IXGGZSQRWYAHMM-UHFFFAOYSA-N 1 1 397.260 3.025 10 0 GGAEMO Cc1[nH+]ccn1-c1ccc(CNC(=O)c2ncsc2Br)cc1F ZINC000557570642 566397567 /nfs/dbraw/zinc/39/75/67/566397567.db2.gz UJZPJVLXIFZDPR-UHFFFAOYSA-N 1 1 395.257 3.469 10 0 GGAEMO Cc1cc(Br)cc2c1CN(C(=O)CCCC[NH+]1CCOCC1)CC2 ZINC000557585842 566399217 /nfs/dbraw/zinc/39/92/17/566399217.db2.gz SHVNQCLEQLCVDU-UHFFFAOYSA-N 1 1 395.341 3.145 10 0 GGAEMO CN(C(=O)NCCCc1cccc(Br)c1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000601324232 566400175 /nfs/dbraw/zinc/40/01/75/566400175.db2.gz VCLRQSWKDMSECE-KRWDZBQOSA-N 1 1 380.330 3.260 10 0 GGAEMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)[C@H]2CCOc3ccc(Br)cc32)C1 ZINC000649849032 566400320 /nfs/dbraw/zinc/40/03/20/566400320.db2.gz KVFHDAPJKCFRQT-JLJPHGGASA-N 1 1 393.325 3.258 10 0 GGAEMO CCOC(=O)c1cc(C[NH2+][C@H](C)c2ccc(OC)c(Br)c2)on1 ZINC000601311360 566400468 /nfs/dbraw/zinc/40/04/68/566400468.db2.gz WLASLOJFNJPKKS-SNVBAGLBSA-N 1 1 383.242 3.473 10 0 GGAEMO CCNC(=O)C[C@@H]1CCCC[N@H+]1Cc1nc2cc(Br)ccc2o1 ZINC000510640056 566400583 /nfs/dbraw/zinc/40/05/83/566400583.db2.gz GVPDKULPRQRKPI-ZDUSSCGKSA-N 1 1 380.286 3.471 10 0 GGAEMO C[C@@H]1C[N@H+](C2CCOCC2)CCN1c1ncnc2ccc(Br)cc21 ZINC000557594890 566400864 /nfs/dbraw/zinc/40/08/64/566400864.db2.gz ZUDWSOXBTLIWLT-CYBMUJFWSA-N 1 1 391.313 3.082 10 0 GGAEMO C[C@@H](Cn1cc(Br)ccc1=O)[NH2+]Cc1cc(COC(C)(C)C)on1 ZINC000671120901 566401718 /nfs/dbraw/zinc/40/17/18/566401718.db2.gz ZVRYRDSDQQOKBB-LBPRGKRZSA-N 1 1 398.301 3.092 10 0 GGAEMO CN(C)c1cc(NC(=O)[C@H]2CCOc3ccc(Br)cc32)cc[nH+]1 ZINC000649884671 566403407 /nfs/dbraw/zinc/40/34/07/566403407.db2.gz YCDIGFLOKSUJOD-ZDUSSCGKSA-N 1 1 376.254 3.415 10 0 GGAEMO O=C(c1[nH]nc2ccc(Br)cc21)N1CC[NH+](C2CCCCC2)CC1 ZINC000483864450 566404746 /nfs/dbraw/zinc/40/47/46/566404746.db2.gz SCRPYFOCRIWCMQ-UHFFFAOYSA-N 1 1 391.313 3.416 10 0 GGAEMO O=C(N[C@@H]1CC[N@H+]2CCC[C@H]2C1)[C@@H]1CCOc2ccc(Br)cc21 ZINC000649941677 566408129 /nfs/dbraw/zinc/40/81/29/566408129.db2.gz HPRCIJAWTLLYDR-QLFBSQMISA-N 1 1 379.298 3.058 10 0 GGAEMO C[C@H](NC(=O)[C@@H]1[C@@H]2Cc3c(cccc3Br)[C@@H]21)C1=CC[N@@H+](C)CC1 ZINC000626408858 566408890 /nfs/dbraw/zinc/40/88/90/566408890.db2.gz MEEWRNQWFFJVNC-PHTTXTFCSA-N 1 1 375.310 3.101 10 0 GGAEMO CO[C@@H](CC(=O)Nc1ccc(C[NH+](C)C)c(Br)c1)C(F)(F)F ZINC000649951203 566409513 /nfs/dbraw/zinc/40/95/13/566409513.db2.gz IVPJEDQXKLGLQA-LBPRGKRZSA-N 1 1 383.208 3.417 10 0 GGAEMO Cc1cc(Br)cc(C)c1N1CCC[C@@H]([N@@H+](C)CC2(CO)CC2)C1=O ZINC000510775107 566412515 /nfs/dbraw/zinc/41/25/15/566412515.db2.gz BLPOCYOTPHQYGV-MRXNPFEDSA-N 1 1 395.341 3.266 10 0 GGAEMO C[C@H](NC(=O)C[N@H+]1CC[C@]2(C1)CCCOC2)c1ccc(Br)cc1 ZINC000671254515 566412694 /nfs/dbraw/zinc/41/26/94/566412694.db2.gz APMLRMNRNIBVFM-KSSFIOAISA-N 1 1 381.314 3.129 10 0 GGAEMO C[C@@H](NC(=O)C[N@H+]1CC[C@]2(C1)CCCOC2)c1ccc(Br)cc1 ZINC000671254512 566412787 /nfs/dbraw/zinc/41/27/87/566412787.db2.gz APMLRMNRNIBVFM-KDOFPFPSSA-N 1 1 381.314 3.129 10 0 GGAEMO CCNC(=O)C[C@@H]1CCCC[N@H+]1C[C@H](O)COc1ccc(Cl)c(Cl)c1 ZINC000671248953 566413399 /nfs/dbraw/zinc/41/33/99/566413399.db2.gz SGMZDNVMEHUFOH-KBPBESRZSA-N 1 1 389.323 3.114 10 0 GGAEMO C[C@H](NC(=O)c1cc(=O)[nH]c2ccc(Br)cc21)C1=CC[N@@H+](C)CC1 ZINC000510795807 566413882 /nfs/dbraw/zinc/41/38/82/566413882.db2.gz SEFSAQZWOZJPMR-NSHDSACASA-N 1 1 390.281 3.083 10 0 GGAEMO Cc1cc(Br)cc(C)c1N1CCC[C@@H]([N@@H+](C)CCCCO)C1=O ZINC000510813810 566414936 /nfs/dbraw/zinc/41/49/36/566414936.db2.gz ROABJFKDGOENNP-MRXNPFEDSA-N 1 1 383.330 3.266 10 0 GGAEMO CCCOC[C@@H](Cc1cccc(Br)c1)NC(=O)Cn1c[nH+]cc1C ZINC000626499497 566416496 /nfs/dbraw/zinc/41/64/96/566416496.db2.gz XBAZHYASYJEGEM-QGZVFWFLSA-N 1 1 394.313 3.108 10 0 GGAEMO COCCOCC[N@H+]1CCC[C@@H]1c1ccccc1I ZINC000510873248 566417011 /nfs/dbraw/zinc/41/70/11/566417011.db2.gz SEIFCIFEPZTJNV-OAHLLOKOSA-N 1 1 375.250 3.091 10 0 GGAEMO Cc1nc(C[NH+]2CCC(C(=O)NC[C@@H]3CC34CCSCC4)CC2)cs1 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/nfs/dbraw/zinc/54/27/24/566542724.db2.gz SVUFHEKCULSIFI-NXEZZACHSA-N 1 1 378.778 3.181 10 0 GGAEMO COC(=O)[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC000603859207 566542729 /nfs/dbraw/zinc/54/27/29/566542729.db2.gz SVUFHEKCULSIFI-NXEZZACHSA-N 1 1 378.778 3.181 10 0 GGAEMO COc1ncc(C(=O)NCCCC[N@H+]2CCCC[C@@H]2C)cc1Br ZINC000424587243 566543489 /nfs/dbraw/zinc/54/34/89/566543489.db2.gz GXJODIWSSDSJTP-ZDUSSCGKSA-N 1 1 384.318 3.237 10 0 GGAEMO C[C@@H](c1ccccc1)[N@H+]1CC[C@H](NC(=O)c2ncsc2Br)C1 ZINC000512599155 566544697 /nfs/dbraw/zinc/54/46/97/566544697.db2.gz YSSDEGOVVYNGKG-AAEUAGOBSA-N 1 1 380.311 3.471 10 0 GGAEMO C[C@@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)Cc1noc2ccc(Br)cc21 ZINC000424604060 566545775 /nfs/dbraw/zinc/54/57/75/566545775.db2.gz GVEINKNFYFYXTP-STQMWFEESA-N 1 1 394.313 3.369 10 0 GGAEMO O=C(CCCC[NH+]1CCOCC1)NCC/C=C/c1ccc(Br)cc1 ZINC000628334886 566547849 /nfs/dbraw/zinc/54/78/49/566547849.db2.gz AOQAHSFVWCJKNZ-ORCRQEGFSA-N 1 1 395.341 3.471 10 0 GGAEMO Cc1cc(Br)c(C[NH2+][C@@H](C)C2(S(C)(=O)=O)CC2)cc1Cl ZINC000449323156 566548111 /nfs/dbraw/zinc/54/81/11/566548111.db2.gz SEBGOIQQOCCRAB-JTQLQIEISA-N 1 1 380.735 3.466 10 0 GGAEMO C[N@H+]1CCCC12CCN(C(=O)[C@H]1CCOc3ccc(Br)cc31)CC2 ZINC000651647853 566548392 /nfs/dbraw/zinc/54/83/92/566548392.db2.gz BVGXAFFAMQNMIT-HNNXBMFYSA-N 1 1 393.325 3.402 10 0 GGAEMO C[NH+]1CCN(C(=O)C2CCN(Cc3cc(Cl)sc3Cl)CC2)CC1 ZINC000449325801 566550226 /nfs/dbraw/zinc/55/02/26/566550226.db2.gz PRNIRHIWKQOMAF-UHFFFAOYSA-N 1 1 376.353 3.041 10 0 GGAEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)NCCc1nc(C(F)(F)F)cs1 ZINC000465907530 566551378 /nfs/dbraw/zinc/55/13/78/566551378.db2.gz SUVFLVURYPRUJY-TXEJJXNPSA-N 1 1 378.464 3.267 10 0 GGAEMO CCOc1cc(C[NH2+][C@](C)(CO)c2cccc(O)c2)cc(Br)c1O ZINC000628374573 566552206 /nfs/dbraw/zinc/55/22/06/566552206.db2.gz QMBYMQRBLMHUQH-GOSISDBHSA-N 1 1 396.281 3.256 10 0 GGAEMO COc1cc(Br)ccc1C[NH2+]Cc1ccc2c(c1)NC(=O)CO2 ZINC000512705366 566552276 /nfs/dbraw/zinc/55/22/76/566552276.db2.gz IPTXMIXGYDWPDR-UHFFFAOYSA-N 1 1 377.238 3.078 10 0 GGAEMO O=S1(=O)C[C@@H](C[NH2+]Cc2c(F)cccc2Br)c2ccccc21 ZINC000449355605 566552717 /nfs/dbraw/zinc/55/27/17/566552717.db2.gz BINRSWVJFPTZKL-LLVKDONJSA-N 1 1 384.270 3.249 10 0 GGAEMO Cn1cncc1C[N@H+]1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000449392579 566555788 /nfs/dbraw/zinc/55/57/88/566555788.db2.gz KLEHVEYRZFSVPG-AWEZNQCLSA-N 1 1 381.261 3.089 10 0 GGAEMO Cc1c[nH]nc1C[N@H+]1CC[C@H](Cc2cccc(I)c2)C1 ZINC000449391091 566555714 /nfs/dbraw/zinc/55/57/14/566555714.db2.gz HRAOWAVATVAXFW-CQSZACIVSA-N 1 1 381.261 3.387 10 0 GGAEMO Cc1cn[nH]c1C[N@@H+]1CC[C@H](Cc2cccc(I)c2)C1 ZINC000449391091 566555719 /nfs/dbraw/zinc/55/57/19/566555719.db2.gz HRAOWAVATVAXFW-CQSZACIVSA-N 1 1 381.261 3.387 10 0 GGAEMO Cc1cn[nH]c1C[N@H+]1CC[C@H](Cc2cccc(I)c2)C1 ZINC000449391091 566555725 /nfs/dbraw/zinc/55/57/25/566555725.db2.gz HRAOWAVATVAXFW-CQSZACIVSA-N 1 1 381.261 3.387 10 0 GGAEMO Cc1ncc(C[N@H+]2CC[C@@H](Cc3cccc(I)c3)C2)cn1 ZINC000449388710 566556341 /nfs/dbraw/zinc/55/63/41/566556341.db2.gz AWNLOKXRTAQCIW-HNNXBMFYSA-N 1 1 393.272 3.454 10 0 GGAEMO Cn1cc(C[N@H+]2CC[C@@H](Cc3cccc(I)c3)C2)cn1 ZINC000449395353 566556440 /nfs/dbraw/zinc/55/64/40/566556440.db2.gz POPFIXAYQVBOHS-AWEZNQCLSA-N 1 1 381.261 3.089 10 0 GGAEMO COc1c(Br)ccc(C)c1C(=O)NCCCCn1cc[nH+]c1C ZINC000424678195 566556467 /nfs/dbraw/zinc/55/64/67/566556467.db2.gz BJTYFJHXUHTPMO-UHFFFAOYSA-N 1 1 380.286 3.481 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2noc3ccc(Br)cc32)C[C@H]1C ZINC000424683988 566556766 /nfs/dbraw/zinc/55/67/66/566556766.db2.gz NKMQYHQNBYRNRC-TZMCWYRMSA-N 1 1 394.313 3.464 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2noc3ccc(Br)cc32)[C@H](C)C1 ZINC000424678880 566556783 /nfs/dbraw/zinc/55/67/83/566556783.db2.gz CEDZQBDARDAQJF-MLGOLLRUSA-N 1 1 394.313 3.322 10 0 GGAEMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2noc3ccc(Br)cc32)C[C@@H]1C ZINC000424683986 566556909 /nfs/dbraw/zinc/55/69/09/566556909.db2.gz NKMQYHQNBYRNRC-JSGCOSHPSA-N 1 1 394.313 3.464 10 0 GGAEMO Cn1ccnc1C[N@H+]1CC[C@@H](Cc2cccc(I)c2)C1 ZINC000449389924 566557078 /nfs/dbraw/zinc/55/70/78/566557078.db2.gz FCKOCBFJJSCGHT-AWEZNQCLSA-N 1 1 381.261 3.089 10 0 GGAEMO NC(=O)C[C@H]1C[N@H+](Cc2ccc(-c3ccc(Br)cc3)s2)CCO1 ZINC000628474353 566557597 /nfs/dbraw/zinc/55/75/97/566557597.db2.gz VUOHZRJMOYNPEX-AWEZNQCLSA-N 1 1 395.322 3.254 10 0 GGAEMO NC(=O)C[C@H]1C[N@@H+](Cc2ccc(-c3ccc(Br)cc3)s2)CCO1 ZINC000628474353 566557603 /nfs/dbraw/zinc/55/76/03/566557603.db2.gz VUOHZRJMOYNPEX-AWEZNQCLSA-N 1 1 395.322 3.254 10 0 GGAEMO CC1=CC[N@@H+](CCNC(=O)[C@@H]2CCOc3ccc(Br)cc32)CC1 ZINC000651736026 566558187 /nfs/dbraw/zinc/55/81/87/566558187.db2.gz LBWYBTGGHHFSCC-OAHLLOKOSA-N 1 1 379.298 3.083 10 0 GGAEMO Cn1ccc(C[N@H+]2CC[C@H](Cc3cccc(I)c3)C2)n1 ZINC000449397672 566559187 /nfs/dbraw/zinc/55/91/87/566559187.db2.gz VNYXCOOKJOZBOX-CQSZACIVSA-N 1 1 381.261 3.089 10 0 GGAEMO CN(CC[C@H]1CCCC[N@H+]1C)C(=O)Cc1noc2ccc(Br)cc21 ZINC000424702905 566560497 /nfs/dbraw/zinc/56/04/97/566560497.db2.gz YTFJBIUFCXWLEO-CQSZACIVSA-N 1 1 394.313 3.466 10 0 GGAEMO O[C@@H]1C[C@H]([C@@H]2CCCOC2)[N@@H+](Cc2ccc(Br)c3cccnc23)C1 ZINC000449431189 566562173 /nfs/dbraw/zinc/56/21/73/566562173.db2.gz CYQPZTSXDSIKCJ-IIDMSEBBSA-N 1 1 391.309 3.359 10 0 GGAEMO O[C@@H]1C[C@@H]([C@H]2CCCOC2)[N@@H+](Cc2ccnc3c(Br)cccc23)C1 ZINC000449433575 566562492 /nfs/dbraw/zinc/56/24/92/566562492.db2.gz MXJSXROGGVIUKO-DAYGRLMNSA-N 1 1 391.309 3.359 10 0 GGAEMO CNS(=O)(=O)C[C@@H]1CCC[N@@H+](Cc2ccc(-c3ccc(Cl)cc3)o2)C1 ZINC000628495170 566562688 /nfs/dbraw/zinc/56/26/88/566562688.db2.gz KBHUXVCLKOCXAF-CQSZACIVSA-N 1 1 382.913 3.361 10 0 GGAEMO Cc1cc(Br)cc(C)c1CNC(=O)N[C@H]1C[N@@H+](C2CC2)C[C@@H]1C ZINC000466293877 566563296 /nfs/dbraw/zinc/56/32/96/566563296.db2.gz RUVZVRWQUPOHJK-GUYCJALGSA-N 1 1 380.330 3.348 10 0 GGAEMO CCOC(=O)c1nn(C)cc1C[NH2+]C/C=C\c1ccc(Br)cc1 ZINC000449451260 566564531 /nfs/dbraw/zinc/56/45/31/566564531.db2.gz CYBOSXRXRYRTCT-PLNGDYQASA-N 1 1 378.270 3.162 10 0 GGAEMO C[N@H+]1CCC[C@@H]2CN(C(=O)Cc3noc4ccc(Br)cc43)CC[C@H]21 ZINC000424737887 566564564 /nfs/dbraw/zinc/56/45/64/566564564.db2.gz OIMQDMUEOMDRIH-MLGOLLRUSA-N 1 1 392.297 3.076 10 0 GGAEMO C[C@@H](CNC(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1)Oc1cccc(Br)c1 ZINC000466303071 566564626 /nfs/dbraw/zinc/56/46/26/566564626.db2.gz OAIIFEOITNWNAA-XJKSGUPXSA-N 1 1 396.329 3.095 10 0 GGAEMO C[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000424737959 566564813 /nfs/dbraw/zinc/56/48/13/566564813.db2.gz LZBFAIZVVNINIP-MLGOLLRUSA-N 1 1 392.297 3.076 10 0 GGAEMO COc1cc2c(cc1C[NH2+][C@@](C)(CO)c1ccc(Br)cc1)OCO2 ZINC000512873529 566566240 /nfs/dbraw/zinc/56/62/40/566566240.db2.gz AXHIKOZGTRLWBT-SFHVURJKSA-N 1 1 394.265 3.184 10 0 GGAEMO Cc1cc(Br)cc2c1CN(C(=O)N[C@H]1CC[N@@H+](C)[C@H](C)C1)CC2 ZINC000539227825 566569097 /nfs/dbraw/zinc/56/90/97/566569097.db2.gz ZIACMAHRVSRNDW-CJNGLKHVSA-N 1 1 380.330 3.308 10 0 GGAEMO CSc1cccc(C(=O)NC[C@@H](c2cccs2)N2CC[NH+](C)CC2)c1 ZINC000578953565 566569298 /nfs/dbraw/zinc/56/92/98/566569298.db2.gz MXYFELACTVYWLS-KRWDZBQOSA-N 1 1 375.563 3.189 10 0 GGAEMO CC(C)[N@H+]1CCC[C@H](NC(=O)Cc2noc3ccc(Br)cc32)C1 ZINC000424775072 566569654 /nfs/dbraw/zinc/56/96/54/566569654.db2.gz HVAFCFHEHLMFBB-ZDUSSCGKSA-N 1 1 380.286 3.122 10 0 GGAEMO CN(C[C@H]1CCC[N@@H+](C)C1)C(=O)N[C@@H]1CCOc2ccc(Br)cc21 ZINC000604644246 566571902 /nfs/dbraw/zinc/57/19/02/566571902.db2.gz ADDWLOQKSSQHBX-XJKSGUPXSA-N 1 1 396.329 3.256 10 0 GGAEMO Cc1ccc(-c2nc(C[NH2+]C[C@H]3CCCCN3S(C)(=O)=O)cs2)cc1 ZINC000512998095 566572049 /nfs/dbraw/zinc/57/20/49/566572049.db2.gz UAEMKGYCRINRCR-QGZVFWFLSA-N 1 1 379.551 3.022 10 0 GGAEMO Cc1cc(Br)cc2c1CN(C(=O)N[C@H]1C[N@@H+](C3CC3)C[C@@H]1C)CC2 ZINC000539285389 566572474 /nfs/dbraw/zinc/57/24/74/566572474.db2.gz PJHWKYIDYIYIRG-UGSOOPFHSA-N 1 1 392.341 3.308 10 0 GGAEMO COc1ccc(NC(=O)C[C@H](C)[NH2+][C@@H](C)c2ncc(Br)cn2)cc1 ZINC000559862637 566572512 /nfs/dbraw/zinc/57/25/12/566572512.db2.gz FVTRDJIFTVRZDQ-RYUDHWBXSA-N 1 1 393.285 3.316 10 0 GGAEMO Cc1cc(Br)cc2c1CN(C(=O)N[C@H]1C[N@@H+](C3CC3)C[C@H]1C)CC2 ZINC000539285381 566572673 /nfs/dbraw/zinc/57/26/73/566572673.db2.gz PJHWKYIDYIYIRG-ACJLOTCBSA-N 1 1 392.341 3.308 10 0 GGAEMO O=C(NC[C@@H]1CCCC[N@H+]1C1CC1)[C@H]1CCOc2ccc(Br)cc21 ZINC000651897175 566573178 /nfs/dbraw/zinc/57/31/78/566573178.db2.gz QPFXXFUMUACWSY-HOTGVXAUSA-N 1 1 393.325 3.448 10 0 GGAEMO CCOC(=O)c1nn(C)cc1C[NH2+][C@H]1CCc2c1ccc(F)c2Br ZINC000449547408 566574809 /nfs/dbraw/zinc/57/48/09/566574809.db2.gz HZSCBVYZVDHSOY-AWEZNQCLSA-N 1 1 396.260 3.276 10 0 GGAEMO C[N@H+]1CCC[C@H]1CNC(=O)c1ccc(Br)c(OC(F)(F)F)c1 ZINC000513071549 566577158 /nfs/dbraw/zinc/57/71/58/566577158.db2.gz UQOYOVRJVWGXQM-JTQLQIEISA-N 1 1 381.192 3.172 10 0 GGAEMO COC[C@@H]1C[C@@H](O)C[N@H+]1Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000651937349 566577948 /nfs/dbraw/zinc/57/79/48/566577948.db2.gz FHBALGRYEDRUEN-UONOGXRCSA-N 1 1 383.311 3.154 10 0 GGAEMO COc1cc(Br)ccc1[C@H]1CCCN1C(=O)[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC000628680970 566578178 /nfs/dbraw/zinc/57/81/78/566578178.db2.gz NWMXFGHOYMCIKU-XNRPHZJLSA-N 1 1 381.314 3.461 10 0 GGAEMO CCOc1cc(C[NH+]2CCC(Cn3cnnc3)CC2)cc(Br)c1O ZINC000651954093 566579161 /nfs/dbraw/zinc/57/91/61/566579161.db2.gz FCYRQQLLKHWUIG-UHFFFAOYSA-N 1 1 395.301 3.057 10 0 GGAEMO C[C@@H]1[C@@H]([NH2+]Cc2nn(C)cc2I)C[C@@H]1c1ccccc1 ZINC000449603113 566581579 /nfs/dbraw/zinc/58/15/79/566581579.db2.gz FVDLSDSNHXXHBO-WHOFXGATSA-N 1 1 381.261 3.307 10 0 GGAEMO CCC(C)(C)NC(=O)C[NH2+][C@@](C)(CC(=O)OC)c1ccc(Br)cc1 ZINC000513143436 566582593 /nfs/dbraw/zinc/58/25/93/566582593.db2.gz DDYDSPOQNTWDRY-SFHVURJKSA-N 1 1 399.329 3.122 10 0 GGAEMO C[NH+]1CCN(c2ncc(Br)cc2NC(=O)[C@H]2CCC[C@H](F)C2)CC1 ZINC000424869703 566583575 /nfs/dbraw/zinc/58/35/75/566583575.db2.gz JWHOSQDWGBKIQT-JSGCOSHPSA-N 1 1 399.308 3.063 10 0 GGAEMO COC(=O)C[C@@](C)(NCC[C@@H]1CCC[N@H+]1C)c1ccc(Br)cc1 ZINC000513149462 566583500 /nfs/dbraw/zinc/58/35/00/566583500.db2.gz LAXWBGNTKLBISH-FUHWJXTLSA-N 1 1 383.330 3.301 10 0 GGAEMO COc1ccc(CCC(=O)NC[C@H]2CCCC[N@@H+](C)C2)c(Br)c1 ZINC000628756717 566583499 /nfs/dbraw/zinc/58/34/99/566583499.db2.gz XHAUNHPESWTLKD-CQSZACIVSA-N 1 1 383.330 3.238 10 0 GGAEMO C[N@H+]1CCCC[C@H](CNC(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C1 ZINC000628751254 566584024 /nfs/dbraw/zinc/58/40/24/566584024.db2.gz QGJLWPJJNLHVQR-GFCCVEGCSA-N 1 1 392.297 3.165 10 0 GGAEMO Cc1nc2ccccn2c(=O)c1CC[N@H+]1CCc2cc(Br)ccc2C1 ZINC000579166998 566585007 /nfs/dbraw/zinc/58/50/07/566585007.db2.gz RNBLHDDILYGSGB-UHFFFAOYSA-N 1 1 398.304 3.366 10 0 GGAEMO COc1cc(Br)c(C[N@@H+]2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(OC)c1 ZINC000449667574 566587129 /nfs/dbraw/zinc/58/71/29/566587129.db2.gz GAVLFBAYOHOEGQ-YMTOWFKASA-N 1 1 398.219 3.211 10 0 GGAEMO COc1cc(Br)c(C[N@H+]2CC[C@@H]([C@@H](O)C(F)(F)F)C2)c(OC)c1 ZINC000449667574 566587138 /nfs/dbraw/zinc/58/71/38/566587138.db2.gz GAVLFBAYOHOEGQ-YMTOWFKASA-N 1 1 398.219 3.211 10 0 GGAEMO CC[N@@H+](C)[C@H](C(=O)NCc1cc(Br)cnc1OC)c1ccccc1 ZINC000628794545 566587172 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Brc1ccc(C[N@H+]2CCC[C@@]3(CCOC3)C2)c(N2CCOCC2)c1 ZINC000449684064 566590952 /nfs/dbraw/zinc/59/09/52/566590952.db2.gz QJHUBUGUFAIQPM-LJQANCHMSA-N 1 1 395.341 3.288 10 0 GGAEMO CCCN(C)S(=O)(=O)N[C@@H]1CC[N@H+](C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000539637029 566593379 /nfs/dbraw/zinc/59/33/79/566593379.db2.gz GUZUGACJRQXLAD-IAGOWNOFSA-N 1 1 391.940 3.179 10 0 GGAEMO CCCN(C)S(=O)(=O)N[C@@H]1CC[N@@H+](C(C)C)[C@@H]1c1ccc(Cl)c(F)c1 ZINC000539637029 566593386 /nfs/dbraw/zinc/59/33/86/566593386.db2.gz GUZUGACJRQXLAD-IAGOWNOFSA-N 1 1 391.940 3.179 10 0 GGAEMO C[C@@H](Cc1ccc(Br)cc1)NC(=O)NCc1c[nH+]c2n1CCCC2 ZINC000560065009 566593792 /nfs/dbraw/zinc/59/37/92/566593792.db2.gz DQGSNIFQHQQTEF-ZDUSSCGKSA-N 1 1 391.313 3.412 10 0 GGAEMO C[C@H]1OCC[C@@H]1[N@H+](CCO)Cc1cc(C(F)(F)F)ccc1Br ZINC000449688622 566594739 /nfs/dbraw/zinc/59/47/39/566594739.db2.gz WCPDPUVAOMNQHP-YGRLFVJLSA-N 1 1 382.220 3.440 10 0 GGAEMO C[C@H]1OCC[C@@H]1[N@@H+](CCO)Cc1cc(C(F)(F)F)ccc1Br ZINC000449688622 566594744 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C[C@@H]1C[N@H+](CCO)CCN1Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000449786988 566600613 /nfs/dbraw/zinc/60/06/13/566600613.db2.gz RQPYOIQZWWIDFI-CYBMUJFWSA-N 1 1 396.354 3.071 10 0 GGAEMO C[C@@H]1C[N@@H+](CCO)CCN1Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000449786988 566600619 /nfs/dbraw/zinc/60/06/19/566600619.db2.gz RQPYOIQZWWIDFI-CYBMUJFWSA-N 1 1 396.354 3.071 10 0 GGAEMO C[C@@H]1CN(CCO)CC[N@@H+]1Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000449786988 566600624 /nfs/dbraw/zinc/60/06/24/566600624.db2.gz RQPYOIQZWWIDFI-CYBMUJFWSA-N 1 1 396.354 3.071 10 0 GGAEMO C[C@@H]1CN(CCO)CC[N@H+]1Cc1cnc(-c2ccc(Br)cc2)s1 ZINC000449786988 566600627 /nfs/dbraw/zinc/60/06/27/566600627.db2.gz RQPYOIQZWWIDFI-CYBMUJFWSA-N 1 1 396.354 3.071 10 0 GGAEMO CC(C)C[N@@H+]1CC[C@@H](CNC[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000579344174 566600899 /nfs/dbraw/zinc/60/08/99/566600899.db2.gz VEOGPUQFUDINDK-LSDHHAIUSA-N 1 1 375.340 3.301 10 0 GGAEMO CC(C)C[N@H+]1CC[C@@H](CNC[C@@H](O)COc2c(Cl)cccc2Cl)C1 ZINC000579344174 566600903 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Cc1nnc2ccc(C(=O)Nc3ccc(C[NH+](C)C)c(Br)c3)cn12 ZINC000467073423 566624179 /nfs/dbraw/zinc/62/41/79/566624179.db2.gz GKXAEEXCQDAESI-UHFFFAOYSA-N 1 1 388.269 3.114 10 0 GGAEMO CC[N@@H+](CCc1nnnn1-c1ccccc1)Cc1ccccc1Br ZINC000579628142 566625636 /nfs/dbraw/zinc/62/56/36/566625636.db2.gz KBSPDHFBFDVYFO-UHFFFAOYSA-N 1 1 386.297 3.489 10 0 GGAEMO C[NH+](C)Cc1ccc(NC(=O)[C@@H]2CC(=O)N(C(C)(C)C)C2)cc1Br ZINC000467084057 566625760 /nfs/dbraw/zinc/62/57/60/566625760.db2.gz ZHIWHCAGMFHYPC-CYBMUJFWSA-N 1 1 396.329 3.096 10 0 GGAEMO CC[C@H](Cc1ccccc1Br)C(=O)NC[C@@H]1CCC[N@H+]1CCOC ZINC000467097934 566626186 /nfs/dbraw/zinc/62/61/86/566626186.db2.gz TVDRZCKZKPTQEE-WBVHZDCISA-N 1 1 397.357 3.245 10 0 GGAEMO CCC[C@H](CC)NC(=O)C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000467127847 566627142 /nfs/dbraw/zinc/62/71/42/566627142.db2.gz QUQBMIYAMVWHHC-ZDUSSCGKSA-N 1 1 384.318 3.144 10 0 GGAEMO CC[C@@H](C)[C@@H](C)NC(=O)C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000467124052 566627275 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ZINC000631531721 566807572 /nfs/dbraw/zinc/80/75/72/566807572.db2.gz NRTLIIJAAFPPGG-UHFFFAOYSA-N 1 1 398.308 3.152 10 0 GGAEMO CC1(C)[C@H](NC(=O)Nc2ccc(Br)cc2)C[C@H]1[NH+]1CCOCC1 ZINC000631535442 566807631 /nfs/dbraw/zinc/80/76/31/566807631.db2.gz OKKUHOMKWGESCX-HUUCEWRRSA-N 1 1 382.302 3.070 10 0 GGAEMO O=S(=O)(c1ccc(Cl)s1)N1CCC[N@@H+](CC[C@H]2CCCCO2)CC1 ZINC000542519333 566808914 /nfs/dbraw/zinc/80/89/14/566808914.db2.gz AULLZNWIFCTDAC-CQSZACIVSA-N 1 1 392.974 3.057 10 0 GGAEMO CC[N@@H+](CCNC(=O)Cc1sccc1Br)CCC(F)(F)F ZINC000451385633 566809213 /nfs/dbraw/zinc/80/92/13/566809213.db2.gz SGWSMTICIOVYRM-UHFFFAOYSA-N 1 1 387.265 3.444 10 0 GGAEMO C[N@@H+](Cc1ccccc1)[C@H]1CCN(C(=O)c2c(F)cncc2Br)C1 ZINC000631543957 566809792 /nfs/dbraw/zinc/80/97/92/566809792.db2.gz NTSUBAYDVCDDPR-AWEZNQCLSA-N 1 1 392.272 3.330 10 0 GGAEMO CC[N@@H+](C)C[C@@H]1CCN(C(=O)[C@H]2[C@@H]3c4ccc(Br)cc4C[C@H]23)C1 ZINC000631555374 566810128 /nfs/dbraw/zinc/81/01/28/566810128.db2.gz AQRBRFZZORYPFI-DUOKCRBOSA-N 1 1 377.326 3.135 10 0 GGAEMO CC[C@@H](CO)[NH+]1CCN(C(=O)C2(c3c(Cl)cccc3Cl)CCC2)CC1 ZINC000469753064 566810818 /nfs/dbraw/zinc/81/08/18/566810818.db2.gz PFCFMMOFIIMNHH-AWEZNQCLSA-N 1 1 385.335 3.330 10 0 GGAEMO COc1cc(Br)ccc1[C@H](C)[NH2+]CC(=O)Nc1c(C)nn(C)c1C ZINC000469750824 566811456 /nfs/dbraw/zinc/81/14/56/566811456.db2.gz YWKLWQNSHFBMLI-JTQLQIEISA-N 1 1 395.301 3.097 10 0 GGAEMO COCCOc1c(Cl)cc(NC(=O)N[C@H]2CCC[N@@H+](C)C2)cc1Cl ZINC000678665640 566811994 /nfs/dbraw/zinc/81/19/94/566811994.db2.gz RBLYGUYYFVRCJN-NSHDSACASA-N 1 1 376.284 3.234 10 0 GGAEMO COCCOc1c(Cl)cc(NC(=O)N[C@@H]2CCC[N@@H+](C)C2)cc1Cl ZINC000678665639 566812380 /nfs/dbraw/zinc/81/23/80/566812380.db2.gz RBLYGUYYFVRCJN-LLVKDONJSA-N 1 1 376.284 3.234 10 0 GGAEMO Brc1cccc([C@H]([NH2+]Cc2nnc3n2CCOC3)C2CCC2)c1 ZINC000631620934 566813175 /nfs/dbraw/zinc/81/31/75/566813175.db2.gz LCCULFHHBMHADU-QGZVFWFLSA-N 1 1 377.286 3.202 10 0 GGAEMO Cc1cc(Br)cc2c1CN(C(=O)N[C@@H]1CC[N@@H+](CC3CC3)C1)CC2 ZINC000678720442 566813514 /nfs/dbraw/zinc/81/35/14/566813514.db2.gz SYEOEKPWNSAORS-QGZVFWFLSA-N 1 1 392.341 3.310 10 0 GGAEMO CN(C(=O)CSCc1ccc(Br)cc1F)[C@H]1CCC[N@@H+](C)C1 ZINC000610187849 566814168 /nfs/dbraw/zinc/81/41/68/566814168.db2.gz OWCDAXNPCMNUJR-AWEZNQCLSA-N 1 1 389.334 3.374 10 0 GGAEMO C[C@H]([NH2+]CC(=O)N1CCOC[C@H]1C1CC1)c1cc(F)c(Cl)cc1Cl ZINC000678729085 566815501 /nfs/dbraw/zinc/81/55/01/566815501.db2.gz WYCCWKAEHOWOES-QFYYESIMSA-N 1 1 375.271 3.421 10 0 GGAEMO COC(=O)c1ccc(Br)cc1C[N@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451415701 566815670 /nfs/dbraw/zinc/81/56/70/566815670.db2.gz FTGRPVHAUBZMDI-GVDBMIGSSA-N 1 1 382.298 3.361 10 0 GGAEMO COCC[N@H+](Cc1ccnn1C)Cc1cc(Br)cc2cccnc21 ZINC000489901853 566816231 /nfs/dbraw/zinc/81/62/31/566816231.db2.gz SRARJDWSMQXXOO-UHFFFAOYSA-N 1 1 389.297 3.379 10 0 GGAEMO COCC[N@@H+](Cc1ccnn1C)Cc1cc(Br)cc2cccnc21 ZINC000489901853 566816234 /nfs/dbraw/zinc/81/62/34/566816234.db2.gz SRARJDWSMQXXOO-UHFFFAOYSA-N 1 1 389.297 3.379 10 0 GGAEMO O=S(=O)(C[C@H]1CCC1(F)F)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000631683283 566816353 /nfs/dbraw/zinc/81/63/53/566816353.db2.gz KIKXBKRMLXZLPR-CQSZACIVSA-N 1 1 392.899 3.269 10 0 GGAEMO O=S(=O)(C[C@@H]1CCC1(F)F)NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000631683280 566817068 /nfs/dbraw/zinc/81/70/68/566817068.db2.gz KIKXBKRMLXZLPR-AWEZNQCLSA-N 1 1 392.899 3.269 10 0 GGAEMO Brc1ccc(-c2ncc(C[N@@H+]3CCN4CCOC[C@@H]4C3)s2)cc1 ZINC000542691412 566818245 /nfs/dbraw/zinc/81/82/45/566818245.db2.gz SRAQQHWNGIEZFA-HNNXBMFYSA-N 1 1 394.338 3.089 10 0 GGAEMO Brc1ccc(-c2ncc(C[N@H+]3CCN4CCOC[C@@H]4C3)s2)cc1 ZINC000542691412 566818250 /nfs/dbraw/zinc/81/82/50/566818250.db2.gz SRAQQHWNGIEZFA-HNNXBMFYSA-N 1 1 394.338 3.089 10 0 GGAEMO OCCCOC1CC[NH+](Cc2ccc(OC(F)F)c(Br)c2)CC1 ZINC000678837833 566820656 /nfs/dbraw/zinc/82/06/56/566820656.db2.gz LSTCMONPCDCPLI-UHFFFAOYSA-N 1 1 394.256 3.414 10 0 GGAEMO Cc1c(Br)cccc1CS(=O)(=O)N(C)[C@H]1CC[N@H+](C(C)C)C1 ZINC000655606743 566821199 /nfs/dbraw/zinc/82/11/99/566821199.db2.gz VBDBFUHTECEUIR-HNNXBMFYSA-N 1 1 389.359 3.002 10 0 GGAEMO C[NH+](C)C[C@H](Cc1ccccc1)NC(=O)c1cccc(Br)c1O ZINC000517370792 566822573 /nfs/dbraw/zinc/82/25/73/566822573.db2.gz MNRWWOKMVXSJCJ-AWEZNQCLSA-N 1 1 377.282 3.057 10 0 GGAEMO C[C@@H]1C[C@@H](NC(=O)c2c(F)cncc2Br)C[N@H+]1Cc1ccccc1 ZINC000631768067 566824004 /nfs/dbraw/zinc/82/40/04/566824004.db2.gz ASIXJSOEGDTPCW-TZMCWYRMSA-N 1 1 392.272 3.376 10 0 GGAEMO CC(C)[N@H+](Cc1cc(Br)cc(Br)c1N)C[C@@H](C)O ZINC000469897708 566826707 /nfs/dbraw/zinc/82/67/07/566826707.db2.gz FYXHXCOBCVLXMM-SECBINFHSA-N 1 1 380.124 3.385 10 0 GGAEMO Brc1cnc2[nH]cc(-c3noc(Cn4c[nH+]c5c4CCCC5)n3)c2c1 ZINC000562846549 566826928 /nfs/dbraw/zinc/82/69/28/566826928.db2.gz FOIWTZKUAAJMKG-UHFFFAOYSA-N 1 1 399.252 3.499 10 0 GGAEMO CC[NH+]1CCC(CCNC(=O)c2cc(Br)cc3nc[nH]c32)CC1 ZINC000582069463 566828011 /nfs/dbraw/zinc/82/80/11/566828011.db2.gz VMLAMUJRINYUHB-UHFFFAOYSA-N 1 1 379.302 3.177 10 0 GGAEMO OCC[C@@H]([NH2+]Cc1ccc(-n2cncn2)cc1)c1ccccc1Br ZINC000542838038 566829897 /nfs/dbraw/zinc/82/98/97/566829897.db2.gz HXLBYEMELRCPOL-GOSISDBHSA-N 1 1 387.281 3.243 10 0 GGAEMO OCC[C@H]([NH2+]Cc1ccc(-n2cncn2)cc1)c1ccccc1Br ZINC000542838043 566830058 /nfs/dbraw/zinc/83/00/58/566830058.db2.gz HXLBYEMELRCPOL-SFHVURJKSA-N 1 1 387.281 3.243 10 0 GGAEMO C[NH+](C)C[C@H](NS(=O)(=O)C[C@H]1CCCC1(F)F)c1ccc(Cl)cc1 ZINC000451519707 566831459 /nfs/dbraw/zinc/83/14/59/566831459.db2.gz XLNDLRZHOUQVHU-HIFRSBDPSA-N 1 1 380.888 3.298 10 0 GGAEMO CC[C@H](Cc1ccccc1Br)C(=O)N1CC[NH2+]C[C@@H]1C(F)F ZINC000582116816 566832044 /nfs/dbraw/zinc/83/20/44/566832044.db2.gz JUXYIFDACSVMOQ-BXUZGUMPSA-N 1 1 375.257 3.083 10 0 GGAEMO C[NH+](C)C[C@@H](NS(=O)(=O)C[C@H]1CCCC1(F)F)c1ccc(Cl)cc1 ZINC000451519708 566832179 /nfs/dbraw/zinc/83/21/79/566832179.db2.gz XLNDLRZHOUQVHU-UKRRQHHQSA-N 1 1 380.888 3.298 10 0 GGAEMO O=S(=O)(Cc1cc(Cl)sc1Cl)N[C@H]1CCC[N@H+]2CCCC[C@@H]12 ZINC000655669135 566834255 /nfs/dbraw/zinc/83/42/55/566834255.db2.gz XLYLAFZQFWADEK-RYUDHWBXSA-N 1 1 383.366 3.491 10 0 GGAEMO C[N@@H+](CC(=O)N1CCC[C@@H]1c1nc2cc(Cl)ccc2[nH]1)[C@H]1CCSC1 ZINC000490182811 566834950 /nfs/dbraw/zinc/83/49/50/566834950.db2.gz RKKSQORXZSHEKP-XJKSGUPXSA-N 1 1 378.929 3.317 10 0 GGAEMO C[N@H+](CC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)[C@H]1CCSC1 ZINC000490182811 566834959 /nfs/dbraw/zinc/83/49/59/566834959.db2.gz RKKSQORXZSHEKP-XJKSGUPXSA-N 1 1 378.929 3.317 10 0 GGAEMO C[N@@H+](CC(=O)N1CCC[C@@H]1c1nc2ccc(Cl)cc2[nH]1)[C@H]1CCSC1 ZINC000490182811 566834966 /nfs/dbraw/zinc/83/49/66/566834966.db2.gz RKKSQORXZSHEKP-XJKSGUPXSA-N 1 1 378.929 3.317 10 0 GGAEMO CN(C(=O)COc1ccc(Br)cc1Cl)[C@H]1CC[N@H+](C2CC2)C1 ZINC000517647985 566838113 /nfs/dbraw/zinc/83/81/13/566838113.db2.gz VNOGNQFCUPRNCB-ZDUSSCGKSA-N 1 1 387.705 3.176 10 0 GGAEMO Cc1nn(-c2ccc(Br)cc2)c(C)c1C[N@H+]1C[C@H](O)C2(CC2)C1 ZINC000428389645 566838270 /nfs/dbraw/zinc/83/82/70/566838270.db2.gz MEUOLRDJSJCUAV-KRWDZBQOSA-N 1 1 376.298 3.208 10 0 GGAEMO C[C@@H](c1ccccc1)N(C)C(=O)C[NH2+][C@H](CO)c1cccc(Br)c1 ZINC000542912500 566838253 /nfs/dbraw/zinc/83/82/53/566838253.db2.gz ZIFCBIMMBAKSRY-KBXCAEBGSA-N 1 1 391.309 3.292 10 0 GGAEMO CC[NH+]1CCN(C(=O)NCc2ccc(Br)cc2C(F)(F)F)CC1 ZINC000490234554 566839054 /nfs/dbraw/zinc/83/90/54/566839054.db2.gz DQOGHXDSHPSYIB-UHFFFAOYSA-N 1 1 394.235 3.315 10 0 GGAEMO Brc1ccc(-c2nc(CN[C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)n[nH]2)cc1 ZINC000562959594 566839315 /nfs/dbraw/zinc/83/93/15/566839315.db2.gz YSAPPUSWYMYGKX-BZUAXINKSA-N 1 1 390.329 3.245 10 0 GGAEMO Brc1ccc(-c2n[nH]c(CN[C@@H]3CCC[C@@H]3[C@H]3CCC[NH2+]3)n2)cc1 ZINC000562959594 566839322 /nfs/dbraw/zinc/83/93/22/566839322.db2.gz YSAPPUSWYMYGKX-BZUAXINKSA-N 1 1 390.329 3.245 10 0 GGAEMO Cc1sc2ncnc(SCC(=O)N(C)[C@@H]3CC[N@H+](C4CC4)C3)c2c1C ZINC000517693390 566839888 /nfs/dbraw/zinc/83/98/88/566839888.db2.gz QPNYYGBKWYMBEA-CQSZACIVSA-N 1 1 376.551 3.095 10 0 GGAEMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1 ZINC000610538596 566840580 /nfs/dbraw/zinc/84/05/80/566840580.db2.gz GGGXSQKMVITKJZ-CHWSQXEVSA-N 1 1 390.307 3.397 10 0 GGAEMO C[C@H]1C[N@@H+](CCCNC(=O)CCOc2cccc(Cl)c2Cl)CCCO1 ZINC000470065217 566841464 /nfs/dbraw/zinc/84/14/64/566841464.db2.gz IIRIYJXLBGZUBT-AWEZNQCLSA-N 1 1 389.323 3.379 10 0 GGAEMO C[N@H+]1CCC[C@H](CNS(=O)(=O)C[C@H]2CCC2(F)F)[C@@H]1c1cccs1 ZINC000632027623 566841719 /nfs/dbraw/zinc/84/17/19/566841719.db2.gz IZXQJWORZQEVIF-UMVBOHGHSA-N 1 1 378.510 3.096 10 0 GGAEMO C[C@H](O)C[NH+]1CCN(Cc2cnc(-c3ccc(Br)cc3)s2)CC1 ZINC000428409409 566841976 /nfs/dbraw/zinc/84/19/76/566841976.db2.gz BVTXWYKVKJSSEX-ZDUSSCGKSA-N 1 1 396.354 3.071 10 0 GGAEMO COCC[N@H+]1CCC[C@@H](NC(=O)c2c(C)cc(Br)cc2Cl)C1 ZINC000679231712 566842458 /nfs/dbraw/zinc/84/24/58/566842458.db2.gz YTZYWMUNPKEIEF-CYBMUJFWSA-N 1 1 389.721 3.252 10 0 GGAEMO O[C@@H](C[NH2+]Cc1ccn(C2CCCC2)n1)COc1ccc(Br)cc1 ZINC000517733010 566843116 /nfs/dbraw/zinc/84/31/16/566843116.db2.gz VRQNFEVIUPYIKJ-KRWDZBQOSA-N 1 1 394.313 3.290 10 0 GGAEMO C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NCCC[N@H+]1CCCO[C@@H](C)C1 ZINC000470066459 566843175 /nfs/dbraw/zinc/84/31/75/566843175.db2.gz MFSXQKOZEXWJFO-KBPBESRZSA-N 1 1 389.323 3.378 10 0 GGAEMO C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NCCC[N@H+]1CCCO[C@H](C)C1 ZINC000470066460 566843734 /nfs/dbraw/zinc/84/37/34/566843734.db2.gz MFSXQKOZEXWJFO-KGLIPLIRSA-N 1 1 389.323 3.378 10 0 GGAEMO O=C(c1ccc(Br)cc1C(F)(F)F)N1CC[NH2+]C[C@@H]1C(F)F ZINC000582236198 566844355 /nfs/dbraw/zinc/84/43/55/566844355.db2.gz GLCZTVLEPMMHKC-SNVBAGLBSA-N 1 1 387.146 3.147 10 0 GGAEMO COc1cc(Br)ccc1[C@@H](C)NC1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000655757751 566844401 /nfs/dbraw/zinc/84/44/01/566844401.db2.gz KQIXVLNLYPWJCQ-CZUORRHYSA-N 1 1 383.330 3.362 10 0 GGAEMO Cc1nn(-c2cccc(Br)c2)cc1C[NH2+][C@@H]1CCc2[nH]cnc2C1 ZINC000655776950 566847172 /nfs/dbraw/zinc/84/71/72/566847172.db2.gz NKRNFEDNGQEMRT-OAHLLOKOSA-N 1 1 386.297 3.313 10 0 GGAEMO O=C(NCCc1ccsc1)NC[C@@H]1CSCC[N@@H+]1Cc1ccccc1 ZINC000428470414 566847325 /nfs/dbraw/zinc/84/73/25/566847325.db2.gz OUBMLYFXOZFGGU-GOSISDBHSA-N 1 1 375.563 3.207 10 0 GGAEMO O=C(NCCc1ccsc1)NC[C@@H]1CSCC[N@H+]1Cc1ccccc1 ZINC000428470414 566847333 /nfs/dbraw/zinc/84/73/33/566847333.db2.gz OUBMLYFXOZFGGU-GOSISDBHSA-N 1 1 375.563 3.207 10 0 GGAEMO CC[C@@H]1C[N@@H+](C)CCN1C(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000563064773 566850408 /nfs/dbraw/zinc/85/04/08/566850408.db2.gz WFXQVCGPIKVQDH-IUODEOHRSA-N 1 1 382.302 3.008 10 0 GGAEMO Cc1ccc(I)c(C(=O)NC[C@H]2CCCC[N@H+]2C2CC2)c1 ZINC000470157377 566851920 /nfs/dbraw/zinc/85/19/20/566851920.db2.gz LWRBKIBETWGSDT-CQSZACIVSA-N 1 1 398.288 3.346 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000470166477 566853434 /nfs/dbraw/zinc/85/34/34/566853434.db2.gz VMTHRFKVRVDAJF-INIZCTEOSA-N 1 1 381.314 3.133 10 0 GGAEMO C[NH+](C)[C@H]1C[C@@H](CNCc2ncc(Br)cc2Br)C1 ZINC000655827326 566854062 /nfs/dbraw/zinc/85/40/62/566854062.db2.gz RXAAXVMMVFDIBE-JGZJWPJOSA-N 1 1 377.124 3.036 10 0 GGAEMO Fc1cccc(CC[NH+]2CCN(c3ccc(Br)cn3)CC2)c1F ZINC000543140663 566855941 /nfs/dbraw/zinc/85/59/41/566855941.db2.gz YSFQGIDYPVWKAC-UHFFFAOYSA-N 1 1 382.252 3.487 10 0 GGAEMO CS(=O)(=O)c1ccc(C[NH2+]Cc2cnc(-c3ccccc3)[nH]2)cc1Cl ZINC000428544327 566856240 /nfs/dbraw/zinc/85/62/40/566856240.db2.gz XQJWXOMARUUUJB-UHFFFAOYSA-N 1 1 375.881 3.423 10 0 GGAEMO CN(C)CC[N@@H+](C)CCCN(C)C(=O)C(C)(C)c1cccc(Br)c1 ZINC000582445048 566862894 /nfs/dbraw/zinc/86/28/94/566862894.db2.gz AVHWQTORTPLERH-UHFFFAOYSA-N 1 1 398.389 3.069 10 0 GGAEMO CN(CCCN(C)C(=O)C(C)(C)c1cccc(Br)c1)CC[NH+](C)C ZINC000582445048 566862901 /nfs/dbraw/zinc/86/29/01/566862901.db2.gz AVHWQTORTPLERH-UHFFFAOYSA-N 1 1 398.389 3.069 10 0 GGAEMO Cc1nn(-c2ccncc2)cc1C[NH2+]CCOc1ncc(Cl)cc1Cl ZINC000543237495 566864974 /nfs/dbraw/zinc/86/49/74/566864974.db2.gz DATVERCEWUWGRY-UHFFFAOYSA-N 1 1 378.263 3.446 10 0 GGAEMO O=C(CC[N@@H+]1CCC[C@H](OC(F)F)C1)Nc1cccc(Br)c1 ZINC000679678124 566866096 /nfs/dbraw/zinc/86/60/96/566866096.db2.gz JNSFGYAOJZBWAS-ZDUSSCGKSA-N 1 1 377.229 3.481 10 0 GGAEMO C[N@@H+](C[C@@H](O)CNCc1ccc(Br)cc1C(F)(F)F)C1CC1 ZINC000582481833 566866482 /nfs/dbraw/zinc/86/64/82/566866482.db2.gz JCKVFXMKDLHZGX-ZDUSSCGKSA-N 1 1 381.236 3.013 10 0 GGAEMO CN(C[C@@H](O)C[NH2+]Cc1ccc(Br)cc1C(F)(F)F)C1CC1 ZINC000582481833 566866488 /nfs/dbraw/zinc/86/64/88/566866488.db2.gz JCKVFXMKDLHZGX-ZDUSSCGKSA-N 1 1 381.236 3.013 10 0 GGAEMO Cc1c(Br)cccc1CNC(=O)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC000582496651 566867650 /nfs/dbraw/zinc/86/76/50/566867650.db2.gz HVJXAGCCSVTZMF-QGZVFWFLSA-N 1 1 389.297 3.009 10 0 GGAEMO C[N@H+]1CCCC12CCN(C(=O)[C@@H]1[C@@H]3Cc4cc(Br)ccc4[C@@H]31)CC2 ZINC000632278926 566870507 /nfs/dbraw/zinc/87/05/07/566870507.db2.gz GKMIFJGTDAFWIA-FGTMMUONSA-N 1 1 389.337 3.422 10 0 GGAEMO C[C@]12CC[N@@H+](C[C@@H](O)COc3ccc(Br)cc3)C[C@H]1C2(F)F ZINC000428714829 566872711 /nfs/dbraw/zinc/87/27/11/566872711.db2.gz WLCCNCGPCDIQKQ-YUELXQCFSA-N 1 1 376.241 3.166 10 0 GGAEMO Cc1c2cc(Br)cc(C)c2oc1C(=O)N1C[C@@H]2C[N@@H+](C)C[C@@H]2C1 ZINC000470437578 566872484 /nfs/dbraw/zinc/87/24/84/566872484.db2.gz WJRXIOGNLARESH-BETUJISGSA-N 1 1 377.282 3.446 10 0 GGAEMO NC(=O)[C@@H]([NH2+]C[C@H]1CCC2(CCCC2)O1)c1ccc(Br)cc1F ZINC000656129711 566873058 /nfs/dbraw/zinc/87/30/58/566873058.db2.gz MPZRHYYSDNDDGD-DOMZBBRYSA-N 1 1 385.277 3.196 10 0 GGAEMO CC[C@@H]1C[N@@H+](CCCC(=O)Nc2c(C)cc(Br)cc2C)C[C@H]1O ZINC000679821287 566874581 /nfs/dbraw/zinc/87/45/81/566874581.db2.gz IOOJLTDHJPQMMN-GDBMZVCRSA-N 1 1 383.330 3.487 10 0 GGAEMO C[C@]12CC[N@@H+](C[C@@H](O)COc3cc(F)cc(Br)c3)C[C@H]1C2(F)F ZINC000428728160 566874500 /nfs/dbraw/zinc/87/45/00/566874500.db2.gz RATBFHKEDMQMAI-YUELXQCFSA-N 1 1 394.231 3.305 10 0 GGAEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(Br)c(OC)c(OC)c2)[C@@H](C)C1 ZINC000582560273 566874721 /nfs/dbraw/zinc/87/47/21/566874721.db2.gz RXTBVSOBCUHUFC-SWLSCSKDSA-N 1 1 399.329 3.269 10 0 GGAEMO CNC(=O)[C@@H](C)C[N@@H+](C)CCCC(=O)Nc1c(C)cc(Br)cc1C ZINC000679817705 566874765 /nfs/dbraw/zinc/87/47/65/566874765.db2.gz BDFQNZIZQRTTIT-AWEZNQCLSA-N 1 1 398.345 3.099 10 0 GGAEMO Cc1cc(Br)cc(C)c1NC(=O)CCC[N@@H+](CC(N)=O)C(C)(C)C ZINC000679821664 566874824 /nfs/dbraw/zinc/87/48/24/566874824.db2.gz PGULPNMKIXBSPN-UHFFFAOYSA-N 1 1 398.345 3.370 10 0 GGAEMO Cc1cc(Br)cc(C)c1NC(=O)CCC[N@H+](C)C[C@H](O)C1CC1 ZINC000679820018 566874899 /nfs/dbraw/zinc/87/48/99/566874899.db2.gz VWLIIHBIRGZKKQ-INIZCTEOSA-N 1 1 383.330 3.487 10 0 GGAEMO Cc1cc(Br)cc(C)c1NC(=O)CCC[N@H+]1CCCC[C@@H]1C(N)=O ZINC000679817520 566874964 /nfs/dbraw/zinc/87/49/64/566874964.db2.gz MXWHOJSAIOGJRX-OAHLLOKOSA-N 1 1 396.329 3.124 10 0 GGAEMO CC(C)[N@@H+](C)Cc1ccccc1CNc1cc(Br)cnc1C(N)=O ZINC000543395920 566877093 /nfs/dbraw/zinc/87/70/93/566877093.db2.gz GIVUBEUODMWZDU-UHFFFAOYSA-N 1 1 391.313 3.395 10 0 GGAEMO C[C@H](NC(=O)[C@H]1C[C@]1(C)c1cccc(Br)c1)C1=CC[N@@H+](C)CC1 ZINC000632367617 566878667 /nfs/dbraw/zinc/87/86/67/566878667.db2.gz RSOZNZMCZNQDSD-BOFPYLFWSA-N 1 1 377.326 3.493 10 0 GGAEMO Cc1ccc(CNC(=O)c2c(F)cncc2Br)c(N2CCCC2)[nH+]1 ZINC000632364898 566878818 /nfs/dbraw/zinc/87/88/18/566878818.db2.gz IQDQAWFIFAQWKA-UHFFFAOYSA-N 1 1 393.260 3.217 10 0 GGAEMO C[C@@H](NC(=O)c1c(F)cncc1Br)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000632370425 566879615 /nfs/dbraw/zinc/87/96/15/566879615.db2.gz ZRCXCMXTMZIOSR-VXGBXAGGSA-N 1 1 384.293 3.366 10 0 GGAEMO COc1ccc(CCC(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)cc1Br ZINC000518364430 566879607 /nfs/dbraw/zinc/87/96/07/566879607.db2.gz AYVROVFXHCLQPS-HNNXBMFYSA-N 1 1 381.314 3.085 10 0 GGAEMO Cc1nc(-c2ccc(Br)cc2)c(NC(=O)C[N@@H+]2CC[C@H](C)C2)n1C ZINC000563385014 566879798 /nfs/dbraw/zinc/87/97/98/566879798.db2.gz JLQBFKABLWEQEC-LBPRGKRZSA-N 1 1 391.313 3.438 10 0 GGAEMO CS(=O)(=O)CC[C@@H]1CCCC[N@@H+]1CCOc1ccc(C(F)(F)F)cc1 ZINC000428836855 566883053 /nfs/dbraw/zinc/88/30/53/566883053.db2.gz CMNCDIZXDCDLED-HNNXBMFYSA-N 1 1 379.444 3.373 10 0 GGAEMO CS(=O)(=O)CC[C@@H]1CCCC[N@H+]1CCOc1ccc(C(F)(F)F)cc1 ZINC000428836855 566883063 /nfs/dbraw/zinc/88/30/63/566883063.db2.gz CMNCDIZXDCDLED-HNNXBMFYSA-N 1 1 379.444 3.373 10 0 GGAEMO Cn1cc(Br)c(CNc2nc(N3CCCC(C)(C)C3)cc[nH+]2)n1 ZINC000656194851 566884529 /nfs/dbraw/zinc/88/45/29/566884529.db2.gz UCFBJZVRJSCCFK-UHFFFAOYSA-N 1 1 379.306 3.211 10 0 GGAEMO CN(Cc1ccccc1Br)C(=O)C[N@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1 ZINC000543483130 566885595 /nfs/dbraw/zinc/88/55/95/566885595.db2.gz IGOADJNFPZBSDI-RDJZCZTQSA-N 1 1 397.357 3.136 10 0 GGAEMO C[C@@H](C[NH+]1CCOCC1)C(=O)N1CCC[C@H]1c1ccccc1Br ZINC000680011881 566885850 /nfs/dbraw/zinc/88/58/50/566885850.db2.gz HFTMWTVHNWPSIV-YOEHRIQHSA-N 1 1 381.314 3.081 10 0 GGAEMO C[C@@H](C[NH+]1CCOCC1)C(=O)N1CCC[C@@H]1c1ccccc1Br ZINC000680011879 566886196 /nfs/dbraw/zinc/88/61/96/566886196.db2.gz HFTMWTVHNWPSIV-WMLDXEAASA-N 1 1 381.314 3.081 10 0 GGAEMO CS(=O)(=O)CC[C@@H]1CCCC[N@@H+]1CCOc1cccc(Br)c1 ZINC000428871949 566886714 /nfs/dbraw/zinc/88/67/14/566886714.db2.gz MPMXVRHORHLQII-HNNXBMFYSA-N 1 1 390.343 3.117 10 0 GGAEMO CS(=O)(=O)CC[C@@H]1CCCC[N@H+]1CCOc1cccc(Br)c1 ZINC000428871949 566886720 /nfs/dbraw/zinc/88/67/20/566886720.db2.gz MPMXVRHORHLQII-HNNXBMFYSA-N 1 1 390.343 3.117 10 0 GGAEMO CS(=O)(=O)CC[C@H]1CCCC[N@H+]1CCc1cccc(OC(F)(F)F)c1 ZINC000428859728 566886871 /nfs/dbraw/zinc/88/68/71/566886871.db2.gz DAPBASZEUXIZIL-OAHLLOKOSA-N 1 1 379.444 3.417 10 0 GGAEMO O[C@@H](C[NH2+]Cc1nccn1CC(F)(F)F)COc1c(Cl)cccc1Cl ZINC000518517655 566888473 /nfs/dbraw/zinc/88/84/73/566888473.db2.gz JTJSFBJAFMBHFU-JTQLQIEISA-N 1 1 398.212 3.282 10 0 GGAEMO Cc1nn(-c2cccc(Br)c2)cc1C[N@@H+]1C[C@H](C(N)=O)CC[C@H]1C ZINC000656249799 566888801 /nfs/dbraw/zinc/88/88/01/566888801.db2.gz CKEVQMODSOUKQF-TZMCWYRMSA-N 1 1 391.313 3.029 10 0 GGAEMO Cc1[nH+]cc2n1C[C@@H](C(=O)Nc1ccc(CN(C)C)c(Br)c1)CC2 ZINC000582729261 566889638 /nfs/dbraw/zinc/88/96/38/566889638.db2.gz IWMAGUZITXTVCH-AWEZNQCLSA-N 1 1 391.313 3.217 10 0 GGAEMO C[C@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1c(F)cncc1Br ZINC000632482646 566889917 /nfs/dbraw/zinc/88/99/17/566889917.db2.gz HLMSKHRNBIIIAY-LRDDRELGSA-N 1 1 392.272 3.234 10 0 GGAEMO O=C(NCC[NH+]1CCSCC1)N1CCC[C@H]1c1ccc(Br)cc1 ZINC000491036640 566890010 /nfs/dbraw/zinc/89/00/10/566890010.db2.gz YTPLPUSUIVAHKI-INIZCTEOSA-N 1 1 398.370 3.344 10 0 GGAEMO Cc1nn(-c2ccccc2Br)cc1C[N@H+]1CCCC[C@H]1CC(N)=O ZINC000656251096 566890261 /nfs/dbraw/zinc/89/02/61/566890261.db2.gz GVYOXCAMKLUEHS-HNNXBMFYSA-N 1 1 391.313 3.173 10 0 GGAEMO C[C@@H]1C[N@@H+](Cc2ccccc2)C[C@@H]1NC(=O)c1c(F)cncc1Br ZINC000632482648 566890597 /nfs/dbraw/zinc/89/05/97/566890597.db2.gz HLMSKHRNBIIIAY-WBMJQRKESA-N 1 1 392.272 3.234 10 0 GGAEMO Cc1nn(-c2ccccc2Br)cc1C[N@@H+]1C[C@@H](C(N)=O)CC[C@H]1C ZINC000656250620 566891018 /nfs/dbraw/zinc/89/10/18/566891018.db2.gz WLJMKJQBFBIXFN-OCCSQVGLSA-N 1 1 391.313 3.029 10 0 GGAEMO CCc1oc(C[NH2+][C@](C)(CO)c2ccc(Br)cc2)cc1C(=O)OC ZINC000582752556 566891300 /nfs/dbraw/zinc/89/13/00/566891300.db2.gz XWWPZXPHHAASHN-GOSISDBHSA-N 1 1 396.281 3.388 10 0 GGAEMO CCC(=O)N[C@H]1CCC[N@H+](Cc2ccc(Br)c3cccnc23)C1 ZINC000491078311 566892212 /nfs/dbraw/zinc/89/22/12/566892212.db2.gz OFZIACOEZOMRMF-AWEZNQCLSA-N 1 1 376.298 3.488 10 0 GGAEMO CCC(=O)N[C@H]1CCC[N@@H+](Cc2ccc(Br)c3cccnc23)C1 ZINC000491078311 566892216 /nfs/dbraw/zinc/89/22/16/566892216.db2.gz OFZIACOEZOMRMF-AWEZNQCLSA-N 1 1 376.298 3.488 10 0 GGAEMO Cc1cc(Br)cc(C)c1CNC(=O)Cn1c[nH+]c2c1CCCC2 ZINC000543617457 566892294 /nfs/dbraw/zinc/89/22/94/566892294.db2.gz WQNKSJBYUJQFBQ-UHFFFAOYSA-N 1 1 376.298 3.458 10 0 GGAEMO COCC[N@H+](Cc1cn(-c2ccccc2Br)nc1C)[C@@H]1CCOC1 ZINC000656257830 566892383 /nfs/dbraw/zinc/89/23/83/566892383.db2.gz LFQQMWTUEGYEBB-MRXNPFEDSA-N 1 1 394.313 3.181 10 0 GGAEMO COCC[N@@H+](Cc1cn(-c2ccccc2Br)nc1C)[C@@H]1CCOC1 ZINC000656257830 566892388 /nfs/dbraw/zinc/89/23/88/566892388.db2.gz LFQQMWTUEGYEBB-MRXNPFEDSA-N 1 1 394.313 3.181 10 0 GGAEMO Cc1cc(Br)cc(C)c1CNC(=O)N[C@@H]1C[C@H](C)[N@H+](C2CC2)C1 ZINC000428969413 566892784 /nfs/dbraw/zinc/89/27/84/566892784.db2.gz RKJHAOCOOWXASG-DZGCQCFKSA-N 1 1 380.330 3.490 10 0 GGAEMO COCC[N@H+](Cc1cn(-c2ccccc2Br)nc1C)[C@H]1CCOC1 ZINC000656257829 566893225 /nfs/dbraw/zinc/89/32/25/566893225.db2.gz LFQQMWTUEGYEBB-INIZCTEOSA-N 1 1 394.313 3.181 10 0 GGAEMO COCC[N@@H+](Cc1cn(-c2ccccc2Br)nc1C)[C@H]1CCOC1 ZINC000656257829 566893232 /nfs/dbraw/zinc/89/32/32/566893232.db2.gz LFQQMWTUEGYEBB-INIZCTEOSA-N 1 1 394.313 3.181 10 0 GGAEMO COc1nc(C)cc(C)c1C[NH2+][C@@](C)(CO)c1ccc(Br)cc1 ZINC000563541833 566893306 /nfs/dbraw/zinc/89/33/06/566893306.db2.gz CDOMTPQICBEJKW-SFHVURJKSA-N 1 1 379.298 3.467 10 0 GGAEMO Cc1nn(-c2ccccc2Br)cc1CN1CC[C@@H]2C[N@H+](C)C[C@@H]21 ZINC000656259809 566893675 /nfs/dbraw/zinc/89/36/75/566893675.db2.gz CSJIKCJTNXRLMD-KDOFPFPSSA-N 1 1 375.314 3.079 10 0 GGAEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1cccc(I)c1 ZINC000518600881 566893840 /nfs/dbraw/zinc/89/38/40/566893840.db2.gz ZVQKJHZCEKIXRJ-BETUJISGSA-N 1 1 386.277 3.284 10 0 GGAEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNS(=O)(=O)c1ccc(F)cc1Br ZINC000518620466 566894806 /nfs/dbraw/zinc/89/48/06/566894806.db2.gz RVYKVHLDGGSCNW-TXEJJXNPSA-N 1 1 393.322 3.129 10 0 GGAEMO C[N@H+]1CC[C@@H](NC(=O)Cc2ccc(Br)cc2O)[C@H]1c1ccccc1 ZINC000491119291 566895574 /nfs/dbraw/zinc/89/55/74/566895574.db2.gz VPHGBKXBHVTKQR-VQIMIIECSA-N 1 1 389.293 3.259 10 0 GGAEMO O[C@@H]1C[C@H]2CN(Cc3ccc(-c4ccccc4Br)s3)CC[N@H+]2C1 ZINC000656273154 566896429 /nfs/dbraw/zinc/89/64/29/566896429.db2.gz VKPSKZGJIRSMTO-UONOGXRCSA-N 1 1 393.350 3.428 10 0 GGAEMO C[C@H](C(=O)Nc1cccc(I)c1)[N@@H+]1CC[C@@H](C(F)F)C1 ZINC000611180058 566896675 /nfs/dbraw/zinc/89/66/75/566896675.db2.gz QSVGJMYMYZKQRR-NXEZZACHSA-N 1 1 394.203 3.205 10 0 GGAEMO C[C@H](C(=O)Nc1cccc(I)c1)[N@H+]1CC[C@@H](C(F)F)C1 ZINC000611180058 566896677 /nfs/dbraw/zinc/89/66/77/566896677.db2.gz QSVGJMYMYZKQRR-NXEZZACHSA-N 1 1 394.203 3.205 10 0 GGAEMO Cc1cc(NC(=O)[C@H](C)N2CC[C@@]3(CC[N@@H+](C)C3)C2)ccc1Br ZINC000429005701 566897943 /nfs/dbraw/zinc/89/79/43/566897943.db2.gz SFAYJCKHCSRJEI-KBXCAEBGSA-N 1 1 380.330 3.112 10 0 GGAEMO O=C(Cn1c[nH+]c2c1CCCC2)N(CCO)Cc1ccc(Cl)c(Cl)c1 ZINC000543672420 566898131 /nfs/dbraw/zinc/89/81/31/566898131.db2.gz BXBJYNNIFUAGLO-UHFFFAOYSA-N 1 1 382.291 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GGAEMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](C[C@H](O)COc2ccc(Cl)cc2Cl)C1 ZINC000495067789 567044808 /nfs/dbraw/zinc/04/48/08/567044808.db2.gz OTIUHVFNWPLNBH-OCCSQVGLSA-N 1 1 390.307 3.397 10 0 GGAEMO O[C@]1(CSc2nnc(C(F)(F)F)s2)CC[N@@H+](Cc2ccccc2)C1 ZINC000634648501 567045056 /nfs/dbraw/zinc/04/50/56/567045056.db2.gz SFOXTJGGGHTRCW-CQSZACIVSA-N 1 1 375.441 3.286 10 0 GGAEMO Fc1cncc(Br)c1C[NH2+]CC1(N2CCSCC2)CCCC1 ZINC000657307702 567045976 /nfs/dbraw/zinc/04/59/76/567045976.db2.gz HCYXOYSSJNWDOE-UHFFFAOYSA-N 1 1 388.350 3.434 10 0 GGAEMO COc1cc(Br)ccc1[C@@H](C)NC(=O)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000682458435 567046410 /nfs/dbraw/zinc/04/64/10/567046410.db2.gz XGBLWTUOMUCOAL-DOMZBBRYSA-N 1 1 396.329 3.302 10 0 GGAEMO C[C@@H]([NH2+]Cc1cnn2c1CCC2)c1cc2c(cc1Br)OCCO2 ZINC000657319810 567046954 /nfs/dbraw/zinc/04/69/54/567046954.db2.gz OYGHYLQFTGSRAX-LLVKDONJSA-N 1 1 378.270 3.214 10 0 GGAEMO C[C@H]([NH2+]Cc1cnn2c1CCC2)c1cc2c(cc1Br)OCCO2 ZINC000657319811 567047889 /nfs/dbraw/zinc/04/78/89/567047889.db2.gz OYGHYLQFTGSRAX-NSHDSACASA-N 1 1 378.270 3.214 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(C(=O)c2nn(C(C)(C)C)cc2Br)CC1 ZINC000613612393 567047854 /nfs/dbraw/zinc/04/78/54/567047854.db2.gz VQWRKNAJXABXRH-UHFFFAOYSA-N 1 1 394.317 3.383 10 0 GGAEMO CC[N@H+](CC(=O)N1CCO[C@@H]2CCCC[C@@H]21)Cc1cccc(Br)c1 ZINC000521220960 567048197 /nfs/dbraw/zinc/04/81/97/567048197.db2.gz YWOJMOVUPWXWES-ZWKOTPCHSA-N 1 1 395.341 3.441 10 0 GGAEMO CC[N@@H+](CC(=O)N1CCO[C@@H]2CCCC[C@@H]21)Cc1cccc(Br)c1 ZINC000521220960 567048200 /nfs/dbraw/zinc/04/82/00/567048200.db2.gz YWOJMOVUPWXWES-ZWKOTPCHSA-N 1 1 395.341 3.441 10 0 GGAEMO COc1cccc(N2CC[C@@H]([NH2+]Cc3c(F)cncc3Br)C2)c1 ZINC000657345348 567049374 /nfs/dbraw/zinc/04/93/74/567049374.db2.gz LRVBCXOUUSCLFG-GFCCVEGCSA-N 1 1 380.261 3.360 10 0 GGAEMO Brc1ccccc1N1CC[C@@H]([NH2+]Cc2ccnn2-c2ccncc2)C1 ZINC000657357133 567052601 /nfs/dbraw/zinc/05/26/01/567052601.db2.gz RBTSHWAUKQPLCD-OAHLLOKOSA-N 1 1 398.308 3.398 10 0 GGAEMO C[NH+](C)CC(=O)Nc1ccc(NCc2c(F)cncc2Br)cc1 ZINC000657409370 567054575 /nfs/dbraw/zinc/05/45/75/567054575.db2.gz WVNRJJMHEAAFBE-UHFFFAOYSA-N 1 1 381.249 3.095 10 0 GGAEMO COc1cc(Br)ccc1C[NH2+]Cc1c(C(F)(F)F)cnn1C ZINC000657439779 567055572 /nfs/dbraw/zinc/05/55/72/567055572.db2.gz GLOUFJNWNNZHSK-UHFFFAOYSA-N 1 1 378.192 3.500 10 0 GGAEMO O=C([C@@H]1CCc2cc(Br)ccc21)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC000565304201 567055590 /nfs/dbraw/zinc/05/55/90/567055590.db2.gz POZQHMMGMHKBOX-QZTJIDSGSA-N 1 1 386.293 3.047 10 0 GGAEMO Cc1nc(-c2ccc(Cl)s2)sc1C(=O)NC[C@H]1CCCC[N@H+]1CCO ZINC000584571792 567055936 /nfs/dbraw/zinc/05/59/36/567055936.db2.gz XHFIWTQNFSHWQC-GFCCVEGCSA-N 1 1 399.969 3.410 10 0 GGAEMO C[S@](=O)c1cccc(C(=O)NC[C@@H]2CCC[N@@H+](Cc3cccs3)C2)c1 ZINC000613705008 567056807 /nfs/dbraw/zinc/05/68/07/567056807.db2.gz CLWRFCZPYRGABK-MQNRADLISA-N 1 1 376.547 3.128 10 0 GGAEMO C[S@@](=O)c1cccc(C(=O)NC[C@H]2CCC[N@@H+](Cc3cccs3)C2)c1 ZINC000613705010 567057383 /nfs/dbraw/zinc/05/73/83/567057383.db2.gz CLWRFCZPYRGABK-SGANQWHYSA-N 1 1 376.547 3.128 10 0 GGAEMO O=C(NC[C@H]1CCC[N@@H+](Cc2cccs2)C1)N[C@H](CO)c1ccsc1 ZINC000472962483 567058685 /nfs/dbraw/zinc/05/86/85/567058685.db2.gz WHYMJVXYZWHUIT-RHSMWYFYSA-N 1 1 379.551 3.054 10 0 GGAEMO Cc1cc(C(=O)NCCC[N@H+](C)C(C)C)nn1-c1ccc(Br)cc1 ZINC000431160631 567060140 /nfs/dbraw/zinc/06/01/40/567060140.db2.gz LWMIEAKUKJNTIE-UHFFFAOYSA-N 1 1 393.329 3.403 10 0 GGAEMO CC(C)(C)O[C@@H]1C[C@H]([NH2+]Cc2c(F)cncc2Br)[C@@H]1n1cccn1 ZINC000657485745 567060342 /nfs/dbraw/zinc/06/03/42/567060342.db2.gz MMMIOTLHYZCDPD-XHSDSOJGSA-N 1 1 397.292 3.467 10 0 GGAEMO COC[C@@]1(C[NH2+]Cc2c(F)cncc2Br)OCCc2ccccc21 ZINC000657468419 567061291 /nfs/dbraw/zinc/06/12/91/567061291.db2.gz OKBDSTSZQPSVIX-GOSISDBHSA-N 1 1 395.272 3.187 10 0 GGAEMO CC[N@H+]1CCC[C@H]1CNC(=O)c1cc(C)n(-c2ccc(Br)cc2)n1 ZINC000431166488 567062473 /nfs/dbraw/zinc/06/24/73/567062473.db2.gz KQJFFXGEVLCWNL-INIZCTEOSA-N 1 1 391.313 3.157 10 0 GGAEMO COc1cc(C[NH2+]Cc2c(C3CCC3)cnn2C)c(Br)cc1O ZINC000657501447 567063128 /nfs/dbraw/zinc/06/31/28/567063128.db2.gz YFYYMJFXTCSDET-UHFFFAOYSA-N 1 1 380.286 3.454 10 0 GGAEMO CC(=O)N[C@@H](CCC(C)C)C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000613841281 567065693 /nfs/dbraw/zinc/06/56/93/567065693.db2.gz JUJQQHRGUHJKJO-KRWDZBQOSA-N 1 1 398.345 3.390 10 0 GGAEMO C[NH+]1CCC(CNc2ncc(Br)cc2F)(N2CCCCC2)CC1 ZINC000682663737 567066100 /nfs/dbraw/zinc/06/61/00/567066100.db2.gz FIAUUPUAJSTVRM-UHFFFAOYSA-N 1 1 385.325 3.345 10 0 GGAEMO CC(=O)N[C@H](CCC(C)C)C(=O)Nc1ccc(C[NH+](C)C)c(Br)c1 ZINC000613841282 567066338 /nfs/dbraw/zinc/06/63/38/567066338.db2.gz JUJQQHRGUHJKJO-QGZVFWFLSA-N 1 1 398.345 3.390 10 0 GGAEMO CCOc1ccc2nc(NC(=O)C[NH2+][C@H](CO)c3ccsc3)sc2c1 ZINC000473175249 567066532 /nfs/dbraw/zinc/06/65/32/567066532.db2.gz ZRAQZBLKULJETR-CQSZACIVSA-N 1 1 377.491 3.018 10 0 GGAEMO C[C@@H](C(=O)N1CCSc2ccccc21)[N@@H+]1CCSC2(CCOCC2)C1 ZINC000473196828 567066558 /nfs/dbraw/zinc/06/65/58/567066558.db2.gz CASNVGFVUYMFKR-HNNXBMFYSA-N 1 1 378.563 3.112 10 0 GGAEMO C[C@@H](C(=O)N1CCSc2ccccc21)[N@H+]1CCSC2(CCOCC2)C1 ZINC000473196828 567066564 /nfs/dbraw/zinc/06/65/64/567066564.db2.gz CASNVGFVUYMFKR-HNNXBMFYSA-N 1 1 378.563 3.112 10 0 GGAEMO Cc1c2ccc(C(F)(F)F)nc2sc1C(=O)N1CC[NH2+]C[C@@](C)(F)C1 ZINC000565420811 567067485 /nfs/dbraw/zinc/06/74/85/567067485.db2.gz PLHSVVDOUXBVTB-OAHLLOKOSA-N 1 1 375.391 3.397 10 0 GGAEMO C[C@@H]([NH2+][C@@H]1CCc2[nH]cnc2C1)c1ccc(F)c(I)c1 ZINC000453248055 567067970 /nfs/dbraw/zinc/06/79/70/567067970.db2.gz ISDJSWCRGPRECL-MWLCHTKSSA-N 1 1 385.224 3.362 10 0 GGAEMO C[C@H](C(=O)Nc1ccc(Br)cc1)[N@@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000613887070 567069489 /nfs/dbraw/zinc/06/94/89/567069489.db2.gz HNRHVZIPFPYXPV-ZIAGYGMSSA-N 1 1 389.297 3.446 10 0 GGAEMO C[C@H](C(=O)Nc1ccc(Br)cc1)[N@H+]1CCC[C@@H](c2ccncn2)C1 ZINC000613887070 567069499 /nfs/dbraw/zinc/06/94/99/567069499.db2.gz HNRHVZIPFPYXPV-ZIAGYGMSSA-N 1 1 389.297 3.446 10 0 GGAEMO C[N@@H+](CCNS(=O)(=O)c1ccccc1OC(F)(F)F)C1CCCCC1 ZINC000521641424 567070994 /nfs/dbraw/zinc/07/09/94/567070994.db2.gz LDADMUDISJRJQX-UHFFFAOYSA-N 1 1 380.432 3.128 10 0 GGAEMO C[N@@H+](CCc1ccc(Br)cc1)CC(=O)N1CCO[C@H]2CCCC[C@H]21 ZINC000521656457 567072774 /nfs/dbraw/zinc/07/27/74/567072774.db2.gz KTOQUHYPPNHKOY-MSOLQXFVSA-N 1 1 395.341 3.093 10 0 GGAEMO CN1c2ccccc2C[C@@H]([NH2+]Cc2cc(Br)cc3c2OCC3)C1=O ZINC000657575147 567072798 /nfs/dbraw/zinc/07/27/98/567072798.db2.gz XCXPPSICBBOUGB-MRXNPFEDSA-N 1 1 387.277 3.061 10 0 GGAEMO O=C(NC[C@H]1CC[N@@H+](Cc2ccccc2)C1)c1ncsc1Br ZINC000565485454 567072960 /nfs/dbraw/zinc/07/29/60/567072960.db2.gz DKGVUVJRPSILKW-CYBMUJFWSA-N 1 1 380.311 3.158 10 0 GGAEMO COc1cc(Br)ccc1C[NH2+][C@H]1Cc2ccccc2N(C)C1=O ZINC000657575245 567073014 /nfs/dbraw/zinc/07/30/14/567073014.db2.gz ZSLIOHPEFFZDLB-HNNXBMFYSA-N 1 1 375.266 3.135 10 0 GGAEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNC(=O)c1cc(Br)c2c(c1)OCCO2 ZINC000521683514 567073795 /nfs/dbraw/zinc/07/37/95/567073795.db2.gz HGIPLMXYFPGOGP-BETUJISGSA-N 1 1 397.313 3.213 10 0 GGAEMO Oc1ccc(Br)c(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1 ZINC000657596435 567074183 /nfs/dbraw/zinc/07/41/83/567074183.db2.gz NFMSHOIAWZKZCL-SFHVURJKSA-N 1 1 391.309 3.011 10 0 GGAEMO C[C@@H]1CCC[C@@H](C)[NH+]1CCNS(=O)(=O)c1sccc1Br ZINC000521688154 567074223 /nfs/dbraw/zinc/07/42/23/567074223.db2.gz BUJYVYWFSBECQH-GHMZBOCLSA-N 1 1 381.361 3.052 10 0 GGAEMO O[C@H]1CC[N@@H+](Cc2ccc(CNCc3c(F)cccc3Br)cc2)C1 ZINC000657596011 567074564 /nfs/dbraw/zinc/07/45/64/567074564.db2.gz KXBBCTSBQUUZEB-INIZCTEOSA-N 1 1 393.300 3.445 10 0 GGAEMO O[C@@H]1CC[N@@H+](Cc2ccc(CNCc3cc(F)ccc3Br)cc2)C1 ZINC000657598250 567075070 /nfs/dbraw/zinc/07/50/70/567075070.db2.gz ZMRZGRYSBHILON-GOSISDBHSA-N 1 1 393.300 3.445 10 0 GGAEMO C[C@H](CC(=O)N(C)CCC[N@@H+](C)CCN(C)C)c1ccc(Br)cc1 ZINC000584864522 567075282 /nfs/dbraw/zinc/07/52/82/567075282.db2.gz SOVVMTZEIYZQAJ-MRXNPFEDSA-N 1 1 398.389 3.285 10 0 GGAEMO C[C@H](CC(=O)N(C)CCCN(C)CC[NH+](C)C)c1ccc(Br)cc1 ZINC000584864522 567075286 /nfs/dbraw/zinc/07/52/86/567075286.db2.gz SOVVMTZEIYZQAJ-MRXNPFEDSA-N 1 1 398.389 3.285 10 0 GGAEMO COc1ccc(C[N@@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)c(Br)c1O ZINC000496446628 567076132 /nfs/dbraw/zinc/07/61/32/567076132.db2.gz DLLNNZZWBHUDJG-GFCCVEGCSA-N 1 1 394.269 3.413 10 0 GGAEMO CN1CC[C@H]([NH2+]C[C@H](CO)Cc2ccc(F)c(Br)c2)[C@H]2CCC[C@H]21 ZINC000453337213 567076136 /nfs/dbraw/zinc/07/61/36/567076136.db2.gz ASGAZJVNAXVXEL-VVWQDTPRSA-N 1 1 399.348 3.202 10 0 GGAEMO COc1ccc(C[N@H+]2CC[C@@H](c3nc(C4CC4)no3)C2)c(Br)c1O ZINC000496446628 567076140 /nfs/dbraw/zinc/07/61/40/567076140.db2.gz DLLNNZZWBHUDJG-GFCCVEGCSA-N 1 1 394.269 3.413 10 0 GGAEMO Cc1ccc(C(=O)NCCC[N@H+]2C[C@@H](C)O[C@@H](C)C2)c(C)c1Br ZINC000682856458 567076323 /nfs/dbraw/zinc/07/63/23/567076323.db2.gz PNYWMCMWKNOOJN-OKILXGFUSA-N 1 1 383.330 3.295 10 0 GGAEMO FC1(F)C[C@@H]1OCC[NH2+]Cc1c(Br)cncc1Br ZINC000657619469 567076549 /nfs/dbraw/zinc/07/65/49/567076549.db2.gz QAFKVCIRIOIMEA-JTQLQIEISA-N 1 1 386.034 3.120 10 0 GGAEMO O=C(Cc1ccncc1Cl)NC[C@@H]1CSCC[N@@H+]1Cc1ccccc1 ZINC000613994289 567077524 /nfs/dbraw/zinc/07/75/24/567077524.db2.gz SKNGOOGQHOXTAN-QGZVFWFLSA-N 1 1 375.925 3.011 10 0 GGAEMO O=C(Cc1ccncc1Cl)NC[C@@H]1CSCC[N@H+]1Cc1ccccc1 ZINC000613994289 567077530 /nfs/dbraw/zinc/07/75/30/567077530.db2.gz SKNGOOGQHOXTAN-QGZVFWFLSA-N 1 1 375.925 3.011 10 0 GGAEMO CCCOc1ccc(Br)cc1C[NH2+][C@H]1CC[C@H](C)S(=O)(=O)C1 ZINC000657634758 567078521 /nfs/dbraw/zinc/07/85/21/567078521.db2.gz KCWXEQYDDFSBQZ-WFASDCNBSA-N 1 1 390.343 3.293 10 0 GGAEMO CN1CC[C@H]([NH2+]C[C@H](CO)Cc2cc(Br)ccc2F)[C@@H]2CCC[C@@H]21 ZINC000453367417 567080124 /nfs/dbraw/zinc/08/01/24/567080124.db2.gz MMFZCPKHVCFETQ-JXIYXGQPSA-N 1 1 399.348 3.202 10 0 GGAEMO O=C(NCCC[NH2+]Cc1ccc2nc[nH]c2c1)c1cccc(Br)c1 ZINC000521830534 567081150 /nfs/dbraw/zinc/08/11/50/567081150.db2.gz GCIPQAFYABDHTN-UHFFFAOYSA-N 1 1 387.281 3.235 10 0 GGAEMO CC[NH+]1CCN(C[C@H](C)CNC(=O)c2ccc(C)c(Br)c2C)CC1 ZINC000682899473 567081244 /nfs/dbraw/zinc/08/12/44/567081244.db2.gz LYKRJVXJIFCXMR-CQSZACIVSA-N 1 1 396.373 3.069 10 0 GGAEMO CC[NH+]1CCN(C[C@@H](C)CNC(=O)c2ccc(C)c(Br)c2C)CC1 ZINC000682899472 567081542 /nfs/dbraw/zinc/08/15/42/567081542.db2.gz LYKRJVXJIFCXMR-AWEZNQCLSA-N 1 1 396.373 3.069 10 0 GGAEMO O=C(Cc1ccc(Br)c(Cl)c1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614091204 567081945 /nfs/dbraw/zinc/08/19/45/567081945.db2.gz CSTNSCSSCWYUDZ-GJZGRUSLSA-N 1 1 389.696 3.290 10 0 GGAEMO O=C(c1c[nH]c2cccc(Br)c12)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614090948 567081986 /nfs/dbraw/zinc/08/19/86/567081986.db2.gz BLWVWCCVSKVRRB-DZGCQCFKSA-N 1 1 380.261 3.189 10 0 GGAEMO O=C(c1cc(Cl)c(Br)cc1F)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614089083 567082584 /nfs/dbraw/zinc/08/25/84/567082584.db2.gz HASRTEVYOJFULQ-UONOGXRCSA-N 1 1 393.659 3.500 10 0 GGAEMO O=C(c1c[nH]c2cccc(Br)c12)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614090957 567082632 /nfs/dbraw/zinc/08/26/32/567082632.db2.gz BLWVWCCVSKVRRB-HIFRSBDPSA-N 1 1 380.261 3.189 10 0 GGAEMO O=C(CCc1cc(Br)ccc1F)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614091052 567082850 /nfs/dbraw/zinc/08/28/50/567082850.db2.gz CFHCCXMKENOEHF-HOTGVXAUSA-N 1 1 387.268 3.166 10 0 GGAEMO O=C(CCc1cc(Br)ccc1F)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614091054 567082940 /nfs/dbraw/zinc/08/29/40/567082940.db2.gz CFHCCXMKENOEHF-JKSUJKDBSA-N 1 1 387.268 3.166 10 0 GGAEMO O=C(c1nc2ccccc2cc1Br)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614088247 567082978 /nfs/dbraw/zinc/08/29/78/567082978.db2.gz AMMCWOBNKGTCNM-HOCLYGCPSA-N 1 1 392.272 3.256 10 0 GGAEMO CC(C)(C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1)c1ccccc1Br ZINC000614097534 567083681 /nfs/dbraw/zinc/08/36/81/567083681.db2.gz IHZHXBQNWGNTQY-HZPDHXFCSA-N 1 1 383.305 3.371 10 0 GGAEMO O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614096968 567083862 /nfs/dbraw/zinc/08/38/62/567083862.db2.gz DARLGIMSRJJEMY-KGLIPLIRSA-N 1 1 393.659 3.500 10 0 GGAEMO O=C(c1ccc(Cl)c(Br)c1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614092888 567084165 /nfs/dbraw/zinc/08/41/65/567084165.db2.gz HFWZQSCIYNQKQP-UONOGXRCSA-N 1 1 375.669 3.361 10 0 GGAEMO O=C(c1cc(F)c(Br)cc1Cl)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000614096971 567084191 /nfs/dbraw/zinc/08/41/91/567084191.db2.gz DARLGIMSRJJEMY-ZIAGYGMSSA-N 1 1 393.659 3.500 10 0 GGAEMO O=C(CCCc1cccc(Br)c1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614093011 567084437 /nfs/dbraw/zinc/08/44/37/567084437.db2.gz HVBDFGJIABBQLY-DLBZAZTESA-N 1 1 383.305 3.417 10 0 GGAEMO COc1cc(C)c(Br)cc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614099521 567084548 /nfs/dbraw/zinc/08/45/48/567084548.db2.gz WEGZDHIGJJNLKA-LSDHHAIUSA-N 1 1 385.277 3.024 10 0 GGAEMO O=C(c1ccc(Cl)cc1Br)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000614095067 567084657 /nfs/dbraw/zinc/08/46/57/567084657.db2.gz QZMIDMZDEPPORV-UONOGXRCSA-N 1 1 375.669 3.361 10 0 GGAEMO Cc1ccc(CCC(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)c(Br)c1 ZINC000614092755 567084703 /nfs/dbraw/zinc/08/47/03/567084703.db2.gz LUUOXSZXESPYCT-IRXDYDNUSA-N 1 1 383.305 3.335 10 0 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ZINC000433210338 567233765 /nfs/dbraw/zinc/23/37/65/567233765.db2.gz VOZVVDDEDNVEBU-ZDUSSCGKSA-N 1 1 397.313 3.116 10 0 GGAEMO COc1cc[nH+]c(N2CCN(Cc3ncc(Br)cc3Cl)CC2)c1 ZINC000659882447 567234490 /nfs/dbraw/zinc/23/44/90/567234490.db2.gz WTDMEPINANJMFS-UHFFFAOYSA-N 1 1 397.704 3.223 10 0 GGAEMO O=C1[C@@H]([N@H+]2CCC[C@]3(CCCOC3)C2)CCN1c1cccc(Br)c1 ZINC000433266211 567237297 /nfs/dbraw/zinc/23/72/97/567237297.db2.gz RSYNHZGRHNBFAG-HKUYNNGSSA-N 1 1 393.325 3.447 10 0 GGAEMO Cc1nc(CCNC(=O)NC[C@H]2CCC[N@H+](C)[C@@H]2c2cccs2)cs1 ZINC000525256618 567238587 /nfs/dbraw/zinc/23/85/87/567238587.db2.gz DCIKPBDKFNWJBI-PBHICJAKSA-N 1 1 378.567 3.438 10 0 GGAEMO O=C(C[N@H+](Cc1cccc(Br)c1)C[C@@H]1CCCO1)N1CCCC1 ZINC000525283382 567239554 /nfs/dbraw/zinc/23/95/54/567239554.db2.gz IGUSHRFTRGWNHV-KRWDZBQOSA-N 1 1 381.314 3.053 10 0 GGAEMO O=C(C[N@@H+](Cc1cccc(Br)c1)C[C@@H]1CCCO1)N1CCCC1 ZINC000525283382 567239562 /nfs/dbraw/zinc/23/95/62/567239562.db2.gz IGUSHRFTRGWNHV-KRWDZBQOSA-N 1 1 381.314 3.053 10 0 GGAEMO CO[C@H]1CC[C@@H](C(=O)NC2CC[NH+](Cc3cccc(Br)c3)CC2)C1 ZINC000616326352 567239751 /nfs/dbraw/zinc/23/97/51/567239751.db2.gz CBENSHFZSYDHIV-QAPCUYQASA-N 1 1 395.341 3.345 10 0 GGAEMO Brc1ccc(OCC[N@H+]2CCCC[C@@H]2CN2CCOCC2)cc1 ZINC000525283315 567239945 /nfs/dbraw/zinc/23/99/45/567239945.db2.gz NFJLOJGITGWFCI-QGZVFWFLSA-N 1 1 383.330 3.015 10 0 GGAEMO COC(=O)c1ccc(C[N@@H+]2CCCN(Cc3cscn3)CC2)cc1Cl ZINC000590690931 567240046 /nfs/dbraw/zinc/24/00/46/567240046.db2.gz UWBNGTOKURJXRY-UHFFFAOYSA-N 1 1 379.913 3.291 10 0 GGAEMO COC(=O)c1ccc(C[N@H+]2CCCN(Cc3cscn3)CC2)cc1Cl ZINC000590690931 567240052 /nfs/dbraw/zinc/24/00/52/567240052.db2.gz UWBNGTOKURJXRY-UHFFFAOYSA-N 1 1 379.913 3.291 10 0 GGAEMO CO[C@@H]1CC[C@@H](C(=O)NC2CC[NH+](Cc3cccc(Br)c3)CC2)C1 ZINC000616326350 567240229 /nfs/dbraw/zinc/24/02/29/567240229.db2.gz CBENSHFZSYDHIV-CRAIPNDOSA-N 1 1 395.341 3.345 10 0 GGAEMO O=C(C[N@H+](Cc1cccc(Br)c1)C[C@H]1CCCO1)N1CCCC1 ZINC000525283383 567240374 /nfs/dbraw/zinc/24/03/74/567240374.db2.gz 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ZINC000567377119 567242135 /nfs/dbraw/zinc/24/21/35/567242135.db2.gz RHRUSSUDJSSSCE-CQSZACIVSA-N 1 1 389.233 3.167 10 0 GGAEMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1c(F)c(F)c(Br)c(F)c1F ZINC000616384373 567242532 /nfs/dbraw/zinc/24/25/32/567242532.db2.gz QSJYMPGAIWNEMF-SSDOTTSWSA-N 1 1 383.183 3.172 10 0 GGAEMO CSC[C@@H](CCO)Nc1nc(C[NH+]2CCCC2)nc2sc(C)c(C)c21 ZINC000525363966 567243219 /nfs/dbraw/zinc/24/32/19/567243219.db2.gz XCRMUINKWLGWMH-CQSZACIVSA-N 1 1 380.583 3.430 10 0 GGAEMO CN(C[C@H]1CCC[N@H+]1C)C(=O)c1cc(Br)cc(N2CCCC2)c1 ZINC000616384330 567243116 /nfs/dbraw/zinc/24/31/16/567243116.db2.gz PRDCVNKWBBBZSE-MRXNPFEDSA-N 1 1 380.330 3.216 10 0 GGAEMO NC(=O)[C@@H](C[NH2+]Cc1ncc(C(F)(F)F)s1)Cc1ccccc1Cl ZINC000433343180 567244473 /nfs/dbraw/zinc/24/44/73/567244473.db2.gz NBVZWQMVFPBUAP-SNVBAGLBSA-N 1 1 377.819 3.249 10 0 GGAEMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1cc(=O)n2cc(Br)ccc2n1 ZINC000547771105 567245270 /nfs/dbraw/zinc/24/52/70/567245270.db2.gz QZNBEPGZAPCQPH-JOYOIKCWSA-N 1 1 390.203 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/nfs/dbraw/zinc/25/06/30/567250630.db2.gz MVVMIGAPLULMNP-ZDUSSCGKSA-N 1 1 376.316 3.072 10 0 GGAEMO CC(C)(C)OCC[NH2+][C@@H]1CCS(=O)(=O)c2ccc(Br)cc21 ZINC000547825777 567250729 /nfs/dbraw/zinc/25/07/29/567250729.db2.gz MVVMIGAPLULMNP-CYBMUJFWSA-N 1 1 376.316 3.072 10 0 GGAEMO CC(C)(C)[N@H+]1CCc2nc(NC(=O)Cc3csc4nccn34)sc2C1 ZINC000567494598 567251441 /nfs/dbraw/zinc/25/14/41/567251441.db2.gz RSZOWUFSFROUOQ-UHFFFAOYSA-N 1 1 375.523 3.190 10 0 GGAEMO C[N@H+]1CCC[C@H](NC(=O)Nc2cc(Cl)ccc2I)C1 ZINC000590841933 567251900 /nfs/dbraw/zinc/25/19/00/567251900.db2.gz RJOHBVZIHRHYPW-JTQLQIEISA-N 1 1 393.656 3.160 10 0 GGAEMO O=S(=O)(NC[C@@H]1C[N@@H+](Cc2ccccc2)CC12CCC2)c1ccsc1 ZINC000660055325 567252133 /nfs/dbraw/zinc/25/21/33/567252133.db2.gz BVYHTBVGHYKNHI-QGZVFWFLSA-N 1 1 376.547 3.329 10 0 GGAEMO O=C(NC[C@H]1CCCC[N@@H+]1CCO)Nc1cccc(Cl)c1Br ZINC000455261555 567254202 /nfs/dbraw/zinc/25/42/02/567254202.db2.gz WESQZYMRDGGXSG-LLVKDONJSA-N 1 1 390.709 3.071 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)NC[C@H](C)[N@H+]1CCCC[C@@H]1C ZINC000525657164 567256810 /nfs/dbraw/zinc/25/68/10/567256810.db2.gz KYWJHDHOXKWIDP-KBPBESRZSA-N 1 1 383.330 3.379 10 0 GGAEMO C/C(=C/c1cccc(C(F)(F)F)c1)C[N@H+]1CCC[C@H](CS(N)(=O)=O)C1 ZINC000567546307 567256913 /nfs/dbraw/zinc/25/69/13/567256913.db2.gz IWWHCGUUWUVEHI-ODDCISTRSA-N 1 1 376.444 3.109 10 0 GGAEMO CCOC(=O)CC[N@@H+](Cc1cc(Br)c(O)c(OCC)c1)C1CC1 ZINC000590951616 567257769 /nfs/dbraw/zinc/25/77/69/567257769.db2.gz KLJLIHSQWKSIDI-UHFFFAOYSA-N 1 1 386.286 3.471 10 0 GGAEMO O=C(NCc1cc(F)cc(Br)c1)NC[C@H]1CCCC[N@H+]1C1CC1 ZINC000433560663 567258034 /nfs/dbraw/zinc/25/80/34/567258034.db2.gz MRBVAZBWKFRNOM-MRXNPFEDSA-N 1 1 384.293 3.404 10 0 GGAEMO O=C(NCc1cc(F)cc(Br)c1)NC[C@@H]1CCCC[N@H+]1C1CC1 ZINC000433560661 567258592 /nfs/dbraw/zinc/25/85/92/567258592.db2.gz MRBVAZBWKFRNOM-INIZCTEOSA-N 1 1 384.293 3.404 10 0 GGAEMO CC[C@H](NC(=O)NC1CCC([NH+]2CCNCC2)CC1)c1ccc(Cl)s1 ZINC000567596283 567259228 /nfs/dbraw/zinc/25/92/28/567259228.db2.gz LRMCBTLDZNRRBK-NRXISQOPSA-N 1 1 384.977 3.368 10 0 GGAEMO C[C@@H]1C[N@H+](CCCCNc2nc(C3CC3)ncc2Br)C[C@H](C)O1 ZINC000685272348 567265488 /nfs/dbraw/zinc/26/54/88/567265488.db2.gz HZRDJZCOPBTLKU-BETUJISGSA-N 1 1 383.334 3.418 10 0 GGAEMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1[nH]nc2ccc(Br)cc21 ZINC000499697902 567265861 /nfs/dbraw/zinc/26/58/61/567265861.db2.gz KGHWWRZFYXQUCQ-CYBMUJFWSA-N 1 1 379.302 3.320 10 0 GGAEMO CC[C@@H]1CCCC[N@@H+]1CCNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000499697902 567265869 /nfs/dbraw/zinc/26/58/69/567265869.db2.gz KGHWWRZFYXQUCQ-CYBMUJFWSA-N 1 1 379.302 3.320 10 0 GGAEMO CC[C@@H]1CCCC[N@H+]1CCNC(=O)c1n[nH]c2ccc(Br)cc21 ZINC000499697902 567265875 /nfs/dbraw/zinc/26/58/75/567265875.db2.gz KGHWWRZFYXQUCQ-CYBMUJFWSA-N 1 1 379.302 3.320 10 0 GGAEMO C[C@@H]1CN(C(=O)Nc2cc(Cl)ccc2C(F)(F)F)C[C@H](C)[N@H+]1CCO ZINC000455402942 567271117 /nfs/dbraw/zinc/27/11/17/567271117.db2.gz ANEBGJGGPDMSKN-PHIMTYICSA-N 1 1 379.810 3.278 10 0 GGAEMO C[C@@H]1CN(C(=O)Nc2cc(Cl)ccc2C(F)(F)F)C[C@H](C)[N@@H+]1CCO ZINC000455402942 567271123 /nfs/dbraw/zinc/27/11/23/567271123.db2.gz ANEBGJGGPDMSKN-PHIMTYICSA-N 1 1 379.810 3.278 10 0 GGAEMO CN(Cc1ccccc1Br)C(=O)C[N@H+]1CCC[C@@]2(CCCOC2)C1 ZINC000475731214 567271633 /nfs/dbraw/zinc/27/16/33/567271633.db2.gz NGLPZYZKYNVXRE-LJQANCHMSA-N 1 1 395.341 3.300 10 0 GGAEMO C[C@H]1CC[C@@H](C(N)=O)C[N@@H+]1Cc1cc(Br)cc(Br)c1 ZINC000685410825 567271728 /nfs/dbraw/zinc/27/17/28/567271728.db2.gz KLHKCPVJFZZPGB-GXSJLCMTSA-N 1 1 390.119 3.297 10 0 GGAEMO C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1cc(Br)cc(Br)c1 ZINC000685410825 567271732 /nfs/dbraw/zinc/27/17/32/567271732.db2.gz KLHKCPVJFZZPGB-GXSJLCMTSA-N 1 1 390.119 3.297 10 0 GGAEMO C[C@@H]1CC[C@H](C(N)=O)C[N@@H+]1Cc1cc(Br)cc(Br)c1 ZINC000685410826 567272258 /nfs/dbraw/zinc/27/22/58/567272258.db2.gz KLHKCPVJFZZPGB-KOLCDFICSA-N 1 1 390.119 3.297 10 0 GGAEMO C[C@@H]1CC[C@H](C(N)=O)C[N@H+]1Cc1cc(Br)cc(Br)c1 ZINC000685410826 567272265 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GGAEMO CCN(C(=O)c1cnn(-c2ccc(Br)cc2)c1)[C@H]1CC[N@@H+](CC)C1 ZINC000617931437 567347113 /nfs/dbraw/zinc/34/71/13/567347113.db2.gz XDEXBJVQTLDFBK-KRWDZBQOSA-N 1 1 391.313 3.191 10 0 GGAEMO CCC[N@@H+](CC)CCNC(=O)Nc1ccc(Br)c(C(=O)OC)c1 ZINC000548737357 567347229 /nfs/dbraw/zinc/34/72/29/567347229.db2.gz ZLCXGVHNGXFEAS-UHFFFAOYSA-N 1 1 386.290 3.089 10 0 GGAEMO CCOc1c(Br)cc(C(=O)N(CC)[C@@H]2CC[N@@H+](CC)C2)cc1OC ZINC000617933049 567347387 /nfs/dbraw/zinc/34/73/87/567347387.db2.gz FAMVHGFGKTWHTP-CQSZACIVSA-N 1 1 399.329 3.413 10 0 GGAEMO C[N@H+]1CCC[C@H](CCNC(=O)N2CCc3ccc(F)c(Br)c3C2)C1 ZINC000527600701 567347993 /nfs/dbraw/zinc/34/79/93/567347993.db2.gz HMGFVLGRLKDEJL-CYBMUJFWSA-N 1 1 398.320 3.388 10 0 GGAEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)N[C@@H]1CCOc2c(Br)cccc21 ZINC000661127149 567349356 /nfs/dbraw/zinc/34/93/56/567349356.db2.gz IHLNJXLJROADHE-IUODEOHRSA-N 1 1 396.329 3.445 10 0 GGAEMO Cc1nc(S(=O)(=O)NC[C@@H](c2ccc(C)cc2)[NH+]2CCCC2)sc1C ZINC000435218066 567349639 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COc1cc(Br)ccc1CCC[N@H+]1CC[C@H](Cn2ccnn2)C1 ZINC000661142044 567351297 /nfs/dbraw/zinc/35/12/97/567351297.db2.gz VPPWHISCNJHOIS-AWEZNQCLSA-N 1 1 379.302 3.004 10 0 GGAEMO O=C(C[N@@H+]1CC[C@@H](Cn2ccnn2)C1)Nc1cc(Cl)c(Cl)cc1Cl ZINC000661140267 567351344 /nfs/dbraw/zinc/35/13/44/567351344.db2.gz HCIPIWUCUDIGHX-SNVBAGLBSA-N 1 1 388.686 3.199 10 0 GGAEMO O=C(C[N@H+]1CC[C@@H](Cn2ccnn2)C1)Nc1cc(Cl)c(Cl)cc1Cl ZINC000661140267 567351349 /nfs/dbraw/zinc/35/13/49/567351349.db2.gz HCIPIWUCUDIGHX-SNVBAGLBSA-N 1 1 388.686 3.199 10 0 GGAEMO Cc1[nH+]cc2n1C[C@H](C(=O)N1CCc3ccc(F)c(Br)c3C1)CC2 ZINC000527627756 567351705 /nfs/dbraw/zinc/35/17/05/567351705.db2.gz GWGHFPHMGWLLFD-CYBMUJFWSA-N 1 1 392.272 3.240 10 0 GGAEMO O=C(Cn1c[nH+]c2c1CCCC2)N[C@@H]1CCOc2c(Br)cccc21 ZINC000548806111 567352351 /nfs/dbraw/zinc/35/23/51/567352351.db2.gz NKXOSDXCJCZQFQ-CQSZACIVSA-N 1 1 390.281 3.164 10 0 GGAEMO Clc1ccc(-c2nnc(C[N@H+]3CC[C@H](Cn4ccnn4)C3)o2)c(Cl)c1 ZINC000661145935 567352583 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CN(CC[C@H]1CCCC[N@H+]1C)C(=O)c1cc(Br)cc2nc[nH]c21 ZINC000548863907 567357198 /nfs/dbraw/zinc/35/71/98/567357198.db2.gz IGNSPQQKRHZHPV-CYBMUJFWSA-N 1 1 379.302 3.272 10 0 GGAEMO Cc1c[nH+]cn1C1CCN(C(=O)c2cc(Br)cc(N(C)C)c2)CC1 ZINC000500987699 567357461 /nfs/dbraw/zinc/35/74/61/567357461.db2.gz DUWILDZLSWGKCT-UHFFFAOYSA-N 1 1 391.313 3.497 10 0 GGAEMO C[C@@]1(Cc2ccccc2Cl)CCC[N@H+]1C[C@@H]1CCCN(S(C)(=O)=O)C1 ZINC000661208647 567357670 /nfs/dbraw/zinc/35/76/70/567357670.db2.gz BERXIEBFFXSOLU-LPHOPBHVSA-N 1 1 384.973 3.409 10 0 GGAEMO CC(C)[N@H+](C)C[C@@H](C)NC(=O)N1CCOc2cc(Br)ccc2C1 ZINC000661204651 567357785 /nfs/dbraw/zinc/35/77/85/567357785.db2.gz IXDDEQVMFSQQAV-CYBMUJFWSA-N 1 1 384.318 3.082 10 0 GGAEMO C[NH+]1CCC(CNCc2ncc(Br)cc2F)(N2CCCCC2)CC1 ZINC000527668736 567358120 /nfs/dbraw/zinc/35/81/20/567358120.db2.gz UALWGQOTHIYJRW-UHFFFAOYSA-N 1 1 399.352 3.023 10 0 GGAEMO O=C(NC[C@H]1CCCC[N@H+]1C1CC1)c1cc(Br)cc2[nH]cnc21 ZINC000548884145 567358998 /nfs/dbraw/zinc/35/89/98/567358998.db2.gz 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NC(=O)c1ncc(Br)cc1NC[C@H]1CCC[N@H+]1C1CCCCC1 ZINC000435597722 567378597 /nfs/dbraw/zinc/37/85/97/567378597.db2.gz NOTPKYCJOLAZGY-CQSZACIVSA-N 1 1 381.318 3.152 10 0 GGAEMO COc1cc(Br)ccc1CNC(=O)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000527868583 567379956 /nfs/dbraw/zinc/37/99/56/567379956.db2.gz UOCRAAUEMNDCNS-MRXNPFEDSA-N 1 1 396.329 3.274 10 0 GGAEMO C[C@H](C(=O)N[C@H]1C[C@H]([NH+]2CCOCC2)C1(C)C)c1ccc(Br)cc1 ZINC000640517909 567382381 /nfs/dbraw/zinc/38/23/81/567382381.db2.gz PWPMYLMPDXASEZ-JQFCIGGWSA-N 1 1 395.341 3.168 10 0 GGAEMO Cc1cc(C)c(Br)c(C(=O)N[C@H]2C[C@H]([NH+]3CCOCC3)C2(C)C)c1 ZINC000640513650 567382495 /nfs/dbraw/zinc/38/24/95/567382495.db2.gz BNHARGPKAHXJHB-HOTGVXAUSA-N 1 1 395.341 3.295 10 0 GGAEMO C[C@@H]([NH2+][C@H](C)C1(S(C)(=O)=O)CC1)c1cc(F)c(Br)cc1F ZINC000527897541 567382939 /nfs/dbraw/zinc/38/29/39/567382939.db2.gz MTECNFPXSDYYGX-RKDXNWHRSA-N 1 1 382.270 3.344 10 0 GGAEMO C[C@@H]([NH2+][C@@H](C)c1cc(F)c(Br)cc1F)C1(S(C)(=O)=O)CC1 ZINC000527897529 567383332 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CCc1ccc(Cl)c(CC)c1NC(=O)CCC[N@H+]1C[C@@H]2C[C@H]1C[S@]2=O ZINC000593099053 567385549 /nfs/dbraw/zinc/38/55/49/567385549.db2.gz HSZDIXJXIZMLQK-XSKAOVLVSA-N 1 1 382.957 3.389 10 0 GGAEMO O[C@H](C[NH2+][C@H](c1ccc(Br)o1)c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000527955318 567386351 /nfs/dbraw/zinc/38/63/51/567386351.db2.gz QWXJPZDRVVFMGI-KEYYUXOJSA-N 1 1 384.245 3.400 10 0 GGAEMO O[C@H](C[NH2+][C@@H](c1ccc(Br)o1)c1ccc(F)cc1)[C@@H]1CCCO1 ZINC000527955315 567386500 /nfs/dbraw/zinc/38/65/00/567386500.db2.gz QWXJPZDRVVFMGI-JKIFEVAISA-N 1 1 384.245 3.400 10 0 GGAEMO Cc1ccc(I)cc1C(=O)NCC[N@@H+]1CCCC[C@@H]1C ZINC000477304536 567386636 /nfs/dbraw/zinc/38/66/36/567386636.db2.gz CFXVFSZIYUJFSD-ZDUSSCGKSA-N 1 1 386.277 3.204 10 0 GGAEMO C[C@@H]1Cc2ccc(Br)cc2C[N@H+]1CCc1nnnn1-c1ccccc1 ZINC000501427309 567388358 /nfs/dbraw/zinc/38/83/58/567388358.db2.gz QWJGKNLOZWYLCY-CQSZACIVSA-N 1 1 398.308 3.414 10 0 GGAEMO CS(=O)(=O)[C@H]1CCCC[C@@H]1[NH2+]Cc1cc(F)c(Br)cc1F ZINC000527981325 567388305 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C[N@H+]1CCC[C@H](NC(=O)N2CCc3[nH]c4ccc(Br)cc4c3C2)C1 ZINC000618560972 567400419 /nfs/dbraw/zinc/40/04/19/567400419.db2.gz AERCPMGRVAZGHQ-ZDUSSCGKSA-N 1 1 391.313 3.092 10 0 GGAEMO Brc1cnn(Cc2c[nH]c(=NC[C@@H]3CC[N@H+]3C3CCCC3)s2)c1 ZINC000528206058 567401058 /nfs/dbraw/zinc/40/10/58/567401058.db2.gz BIYVTSYHQCTUED-AWEZNQCLSA-N 1 1 396.358 3.001 10 0 GGAEMO C[C@@H](C(=O)Nc1ccccc1Br)n1cc(C[NH+]2CCCCC2)nn1 ZINC000640900575 567401489 /nfs/dbraw/zinc/40/14/89/567401489.db2.gz AESABDOCFRIZGR-ZDUSSCGKSA-N 1 1 392.301 3.226 10 0 GGAEMO CN(Cc1ccccc1Br)C(=O)C[NH+]1CCC(c2ccon2)CC1 ZINC000662043439 567404060 /nfs/dbraw/zinc/40/40/60/567404060.db2.gz KTESAENHJNRHFS-UHFFFAOYSA-N 1 1 392.297 3.275 10 0 GGAEMO COc1cc(Br)ccc1CCC[N@H+]1CC[C@H](N(C)C(=O)N(C)C)C1 ZINC000662013563 567404691 /nfs/dbraw/zinc/40/46/91/567404691.db2.gz UKYWZSRNXGTSFB-INIZCTEOSA-N 1 1 398.345 3.078 10 0 GGAEMO C[C@]1(Br)C[C@H]1C(=O)N1CCC([N@H+]2CCc3ccccc3C2)CC1 ZINC000528270117 567405489 /nfs/dbraw/zinc/40/54/89/567405489.db2.gz MMFFRHNPSWPGHI-HKUYNNGSSA-N 1 1 377.326 3.209 10 0 GGAEMO O=c1cc(C[N@H+]2CCC[C@H](C3CCC3)C2)nc2ccc(Br)cn12 ZINC000662045392 567405718 /nfs/dbraw/zinc/40/57/18/567405718.db2.gz SNZDAGISPLHKPF-AWEZNQCLSA-N 1 1 376.298 3.469 10 0 GGAEMO C[C@@H]1C[N@@H+](C)C[C@H](C)N1C(=O)c1cc(Br)ccc1Br ZINC000477694658 567410112 /nfs/dbraw/zinc/41/01/12/567410112.db2.gz OXFBOACOSZBHER-AOOOYVTPSA-N 1 1 390.119 3.376 10 0 GGAEMO C[C@@H]1C[N@H+](C)C[C@H](C)N1C(=O)c1cc(Br)ccc1Br ZINC000477694658 567410114 /nfs/dbraw/zinc/41/01/14/567410114.db2.gz OXFBOACOSZBHER-AOOOYVTPSA-N 1 1 390.119 3.376 10 0 GGAEMO O=C(CC[N@H+]1CCOc2ccc(O)cc2C1)Nc1cccc(Br)c1 ZINC000662101617 567411331 /nfs/dbraw/zinc/41/13/31/567411331.db2.gz SOHYXJPNNILXSM-UHFFFAOYSA-N 1 1 391.265 3.378 10 0 GGAEMO O=C(CC[N@@H+]1CCOc2ccc(O)cc2C1)Nc1cccc(Br)c1 ZINC000662101617 567411334 /nfs/dbraw/zinc/41/13/34/567411334.db2.gz SOHYXJPNNILXSM-UHFFFAOYSA-N 1 1 391.265 3.378 10 0 GGAEMO CC(C)NC(=O)[C@@H]1CCC[N@@H+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000662115630 567412288 /nfs/dbraw/zinc/41/22/88/567412288.db2.gz NEOVYPQUVYFZDJ-CQSZACIVSA-N 1 1 396.329 3.014 10 0 GGAEMO O[C@@H]1CC[N@H+](C2CCN(Cc3oc4ccccc4c3Br)CC2)C1 ZINC000662149738 567412483 /nfs/dbraw/zinc/41/24/83/567412483.db2.gz QDXYYEAXZZGPEV-CQSZACIVSA-N 1 1 379.298 3.226 10 0 GGAEMO CC(C)NC(=O)[C@H]1CCC[N@@H+](CCC(=O)Nc2ccc(Br)cc2)C1 ZINC000662117628 567412503 /nfs/dbraw/zinc/41/25/03/567412503.db2.gz WNKPGYUHZNSPBZ-AWEZNQCLSA-N 1 1 396.329 3.014 10 0 GGAEMO CCCOc1ccc(Br)cc1CN1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC000662151755 567412659 /nfs/dbraw/zinc/41/26/59/567412659.db2.gz KSGGQMNJYYCJCX-GOSISDBHSA-N 1 1 397.357 3.269 10 0 GGAEMO CC(C)NC(=O)[C@H]1CCC[N@@H+](CCC(=O)Nc2cccc(Br)c2)C1 ZINC000662120540 567413304 /nfs/dbraw/zinc/41/33/04/567413304.db2.gz NEOVYPQUVYFZDJ-AWEZNQCLSA-N 1 1 396.329 3.014 10 0 GGAEMO C[N@H+](CC(=O)NC(C)(C)C)Cc1ccc(I)c(Cl)c1 ZINC000436190288 567413570 /nfs/dbraw/zinc/41/35/70/567413570.db2.gz TZDNVKVMBDRRCY-UHFFFAOYSA-N 1 1 394.684 3.291 10 0 GGAEMO C[N@@H+](CC(=O)NC(C)(C)C)Cc1ccc(I)c(Cl)c1 ZINC000436190288 567413577 /nfs/dbraw/zinc/41/35/77/567413577.db2.gz TZDNVKVMBDRRCY-UHFFFAOYSA-N 1 1 394.684 3.291 10 0 GGAEMO OC[C@H]([NH2+]C[C@H](O)COc1c(Cl)cccc1Cl)c1ccc(F)cc1F ZINC000662163018 567414523 /nfs/dbraw/zinc/41/45/23/567414523.db2.gz UBWOFSOIFJVCSR-ZBEGNZNMSA-N 1 1 392.229 3.335 10 0 GGAEMO COc1cc(Br)ccc1CNC(=O)N(C)C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000501989345 567414736 /nfs/dbraw/zinc/41/47/36/567414736.db2.gz NRBFYZSOXXPVLY-XYPWUTKMSA-N 1 1 396.329 3.224 10 0 GGAEMO CCC[N@@H+](C)CC(C)(C)NCC(=O)N(C)Cc1cc(Br)cs1 ZINC000662175936 567415119 /nfs/dbraw/zinc/41/51/19/567415119.db2.gz UHQMFNOAHRIEIU-UHFFFAOYSA-N 1 1 390.391 3.179 10 0 GGAEMO CCCN(C)CC(C)(C)[NH2+]CC(=O)N(C)Cc1cc(Br)cs1 ZINC000662175936 567415125 /nfs/dbraw/zinc/41/51/25/567415125.db2.gz UHQMFNOAHRIEIU-UHFFFAOYSA-N 1 1 390.391 3.179 10 0 GGAEMO CN1C(=O)C[C@@H](Nc2cc[nH+]cc2Br)[C@H]1c1ccc(Cl)cc1 ZINC000501991165 567415484 /nfs/dbraw/zinc/41/54/84/567415484.db2.gz VPGWVOFCJVUQBF-GDBMZVCRSA-N 1 1 380.673 3.303 10 0 GGAEMO COc1ccc([C@H]([NH2+]C[C@@H]2CNCCO2)c2ccccc2)cc1Br ZINC000662259572 567421834 /nfs/dbraw/zinc/42/18/34/567421834.db2.gz YWPRUFMSMBGVSZ-QFBILLFUSA-N 1 1 391.309 3.125 10 0 GGAEMO COc1ccc([C@@H]([NH2+]C[C@@H]2CNCCO2)c2ccccc2)cc1Br ZINC000662259571 567422156 /nfs/dbraw/zinc/42/21/56/567422156.db2.gz YWPRUFMSMBGVSZ-LPHOPBHVSA-N 1 1 391.309 3.125 10 0 GGAEMO C[C@H]1C[N@H+](CCC(=O)NCc2ccccc2Cl)C[C@H](CC(F)(F)F)O1 ZINC000662242260 567422179 /nfs/dbraw/zinc/42/21/79/567422179.db2.gz MMJOPYRDZWXXED-JSGCOSHPSA-N 1 1 378.822 3.388 10 0 GGAEMO C[C@H]1C[N@@H+](CCC(=O)NCc2ccccc2Cl)C[C@H](CC(F)(F)F)O1 ZINC000662242260 567422183 /nfs/dbraw/zinc/42/21/83/567422183.db2.gz MMJOPYRDZWXXED-JSGCOSHPSA-N 1 1 378.822 3.388 10 0 GGAEMO COc1ccc(Br)cc1[C@H]1CCCN1C[C@H]1CCC2(C[NH2+]C2)O1 ZINC000662255199 567422495 /nfs/dbraw/zinc/42/24/95/567422495.db2.gz BCPVBNADHVJMPG-GDBMZVCRSA-N 1 1 381.314 3.116 10 0 GGAEMO Brc1cccc(C[C@@H]2CCCCN2C[C@@H]2CCC3(C[NH2+]C3)O2)c1 ZINC000662282068 567424660 /nfs/dbraw/zinc/42/46/60/567424660.db2.gz CQJRHOIGLNQJJG-ROUUACIJSA-N 1 1 379.342 3.367 10 0 GGAEMO Cc1cc(Br)ccc1NC(=O)CN1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000662297565 567426049 /nfs/dbraw/zinc/42/60/49/567426049.db2.gz RHFPBSZPEYDBJX-MRXNPFEDSA-N 1 1 394.357 3.408 10 0 GGAEMO O=C(c1n[nH]c2ccc(Br)cc21)N1CC[NH+](Cc2ccccc2)CC1 ZINC000569721638 567426986 /nfs/dbraw/zinc/42/69/86/567426986.db2.gz BFZDFIBNOHZQKA-UHFFFAOYSA-N 1 1 399.292 3.283 10 0 GGAEMO COc1cc(Br)ccc1CCCN1CCO[C@@H](CCC[NH+](C)C)C1 ZINC000662323563 567427694 /nfs/dbraw/zinc/42/76/94/567427694.db2.gz NMJODCMXVMAKTL-SFHVURJKSA-N 1 1 399.373 3.433 10 0 GGAEMO C[C@@]1(C(F)F)C[N@H+](CCC(=O)Nc2ccc(Br)cc2F)CCO1 ZINC000662374011 567429546 /nfs/dbraw/zinc/42/95/46/567429546.db2.gz FFEOTCGDFDJFDC-HNNXBMFYSA-N 1 1 395.219 3.273 10 0 GGAEMO C[C@@]1(C(F)F)C[N@@H+](CCC(=O)Nc2ccc(Br)cc2F)CCO1 ZINC000662374011 567429556 /nfs/dbraw/zinc/42/95/56/567429556.db2.gz FFEOTCGDFDJFDC-HNNXBMFYSA-N 1 1 395.219 3.273 10 0 GGAEMO C[NH+](C)[C@@H](CNC(=O)Nc1cnc2c(Br)cccn12)c1ccco1 ZINC000436498625 567429738 /nfs/dbraw/zinc/42/97/38/567429738.db2.gz PDPXZBCTNCZCMQ-LBPRGKRZSA-N 1 1 392.257 3.114 10 0 GGAEMO C[C@@]1(Br)C[C@@H]1C(=O)NCC1([N@H+]2CCOC(C)(C)C2)CCCCC1 ZINC000528497785 567430554 /nfs/dbraw/zinc/43/05/54/567430554.db2.gz RYAAYDFYGLCMFX-RHSMWYFYSA-N 1 1 387.362 3.090 10 0 GGAEMO C[C@@]1(Br)C[C@H]1C(=O)NCC1([N@H+]2CCOC(C)(C)C2)CCCCC1 ZINC000528497786 567430622 /nfs/dbraw/zinc/43/06/22/567430622.db2.gz RYAAYDFYGLCMFX-WMLDXEAASA-N 1 1 387.362 3.090 10 0 GGAEMO COc1ccc(Br)cc1CC(=O)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000456989207 567430624 /nfs/dbraw/zinc/43/06/24/567430624.db2.gz KVADRAMAIYSUQV-QGZVFWFLSA-N 1 1 389.293 3.173 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCO[C@@H](c2ccccc2)C1 ZINC000662374478 567431080 /nfs/dbraw/zinc/43/10/80/567431080.db2.gz IRCLNURRLITOOL-CYBMUJFWSA-N 1 1 393.306 3.328 10 0 GGAEMO O=C(COc1ccc(Br)cc1)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000456997354 567431625 /nfs/dbraw/zinc/43/16/25/567431625.db2.gz QTLPRPFESWBQOX-QGZVFWFLSA-N 1 1 375.266 3.001 10 0 GGAEMO C[NH2+][C@@H](C(=O)NC1CCN(C(=O)C(C)C)CC1)c1cccc(Cl)c1Cl ZINC000662378739 567431707 /nfs/dbraw/zinc/43/17/07/567431707.db2.gz IAWNUGSZJUYOCF-MRXNPFEDSA-N 1 1 386.323 3.017 10 0 GGAEMO O=C(COc1cccc(Br)c1)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000456999633 567431786 /nfs/dbraw/zinc/43/17/86/567431786.db2.gz SZVGUYRTABIMQI-QGZVFWFLSA-N 1 1 375.266 3.001 10 0 GGAEMO C[C@@H]1COCC[N@H+]1C1CCN(Cc2ccc(Br)c(F)c2F)CC1 ZINC000528510821 567431987 /nfs/dbraw/zinc/43/19/87/567431987.db2.gz RBZLDDQQUQADLO-GFCCVEGCSA-N 1 1 389.284 3.412 10 0 GGAEMO O=C(COc1ccc(Br)cc1F)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000457006305 567432076 /nfs/dbraw/zinc/43/20/76/567432076.db2.gz ZPINEDSHKMZMSI-INIZCTEOSA-N 1 1 393.256 3.140 10 0 GGAEMO CO[C@@H](CNC(=O)c1sc2c(c1Br)C[NH2+]C2)c1ccccc1 ZINC000662376023 567432233 /nfs/dbraw/zinc/43/22/33/567432233.db2.gz SDTKUQMPEXQUOS-LBPRGKRZSA-N 1 1 381.295 3.231 10 0 GGAEMO Cn1cc(CC[N@H+]2CCC[C@@H]2c2ccc(I)cc2)cn1 ZINC000550174569 567432309 /nfs/dbraw/zinc/43/23/09/567432309.db2.gz VUGIYTDVVJWCEZ-MRXNPFEDSA-N 1 1 381.261 3.404 10 0 GGAEMO Fc1c(Br)ccc(CN2CCC[C@H]([NH+]3CCOCC3)C2)c1F ZINC000528515946 567432337 /nfs/dbraw/zinc/43/23/37/567432337.db2.gz HGFLFHIPHXJEIE-ZDUSSCGKSA-N 1 1 375.257 3.024 10 0 GGAEMO O=C(NC1(C[NH+]2CCN(c3ccccc3)CC2)CC1)c1sccc1Cl ZINC000619065325 567432388 /nfs/dbraw/zinc/43/23/88/567432388.db2.gz XXJQZARSDRLQAG-UHFFFAOYSA-N 1 1 375.925 3.486 10 0 GGAEMO Cn1cc(CC[N@H+]2CCC[C@H]2c2ccc(I)cc2)cn1 ZINC000550174566 567432516 /nfs/dbraw/zinc/43/25/16/567432516.db2.gz VUGIYTDVVJWCEZ-INIZCTEOSA-N 1 1 381.261 3.404 10 0 GGAEMO C[C@H]1C[C@@H]([NH+]2CCOCC2)CN1Cc1ccc(Br)c(F)c1F ZINC000528509020 567432867 /nfs/dbraw/zinc/43/28/67/567432867.db2.gz QVLVZFRWRXWHLO-WCQYABFASA-N 1 1 375.257 3.022 10 0 GGAEMO O=C(Cc1ccc(F)cc1Br)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000457027737 567433118 /nfs/dbraw/zinc/43/31/18/567433118.db2.gz PSOAAWZEYYLKRY-QGZVFWFLSA-N 1 1 377.257 3.304 10 0 GGAEMO O=C(Cc1cc(Br)ccc1F)N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000457030893 567433260 /nfs/dbraw/zinc/43/32/60/567433260.db2.gz RZNJQOIVQKZGNN-QGZVFWFLSA-N 1 1 377.257 3.304 10 0 GGAEMO CN(C)c1cc(Br)cc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)c1 ZINC000457026747 567433340 /nfs/dbraw/zinc/43/33/40/567433340.db2.gz PKYGCXGIGYXELA-GOSISDBHSA-N 1 1 388.309 3.302 10 0 GGAEMO CC[C@@H](C)C(=O)N1CSC[C@H]1C(=O)Nc1ccc(C[NH+](C)C)c(Cl)c1 ZINC000478045336 567433698 /nfs/dbraw/zinc/43/36/98/567433698.db2.gz JPRGATRJNMBUNF-WBMJQRKESA-N 1 1 383.945 3.288 10 0 GGAEMO O=[S@@]1C[C@@H]2C[C@H]1C[N@H+]2Cc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1 ZINC000593688395 567435035 /nfs/dbraw/zinc/43/50/35/567435035.db2.gz PBCFSTFZKLQVCG-RPSFGLAYSA-N 1 1 387.345 3.264 10 0 GGAEMO O=[S@@]1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1 ZINC000593688395 567435036 /nfs/dbraw/zinc/43/50/36/567435036.db2.gz PBCFSTFZKLQVCG-RPSFGLAYSA-N 1 1 387.345 3.264 10 0 GGAEMO C[C@@H]1C[C@H](S(=O)(=O)N[C@H](C[NH+](C)C)c2ccc(Cl)c(Cl)c2)CCO1 ZINC000528548891 567435816 /nfs/dbraw/zinc/43/58/16/567435816.db2.gz RNKNLYWKPBIMQO-AXAPSJFSSA-N 1 1 395.352 3.083 10 0 GGAEMO CN(C)c1cccc(CNC(=O)c2sc3c(c2Br)C[NH2+]C3)c1 ZINC000662430018 567436331 /nfs/dbraw/zinc/43/63/31/567436331.db2.gz SRAXDUCFIRBZTG-UHFFFAOYSA-N 1 1 380.311 3.110 10 0 GGAEMO O=C(Nc1nc2c(s1)C(=O)CCC2)c1sc2c(c1Br)C[NH2+]C2 ZINC000662435965 567436467 /nfs/dbraw/zinc/43/64/67/567436467.db2.gz IDCMFCXMBJVXGT-UHFFFAOYSA-N 1 1 398.307 3.342 10 0 GGAEMO Cc1ccc2c(c1C)OC[C@H]2NC(=O)[C@H]([NH3+])c1ccccc1Br ZINC000662443618 567436536 /nfs/dbraw/zinc/43/65/36/567436536.db2.gz UJGUWVVOKZAHQG-HZPDHXFCSA-N 1 1 375.266 3.316 10 0 GGAEMO CC1(C)CCC[N@H+]1CCNC(=O)c1cc(=O)[nH]c2ccc(Br)cc21 ZINC000457054861 567436719 /nfs/dbraw/zinc/43/67/19/567436719.db2.gz MBJPMTGHODFXDB-UHFFFAOYSA-N 1 1 392.297 3.307 10 0 GGAEMO Cc1cc(Br)c(S(=O)(=O)NC[C@@H]2CC[N@@H+]2C2CCCC2)s1 ZINC000528554352 567437025 /nfs/dbraw/zinc/43/70/25/567437025.db2.gz UAHAJSCEQWWKLM-LBPRGKRZSA-N 1 1 393.372 3.114 10 0 GGAEMO Cc1cc(Br)c(S(=O)(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)s1 ZINC000528554352 567437029 /nfs/dbraw/zinc/43/70/29/567437029.db2.gz UAHAJSCEQWWKLM-LBPRGKRZSA-N 1 1 393.372 3.114 10 0 GGAEMO C[NH+]1CCN([C@H](CNC(=O)[C@@H]2C[C@H]2c2ccsc2)c2cccs2)CC1 ZINC000528553264 567437499 /nfs/dbraw/zinc/43/74/99/567437499.db2.gz RJEFRHYBRKHNRT-GVDBMIGSSA-N 1 1 375.563 3.018 10 0 GGAEMO CC(C)[N@H+](C)C[C@@H](C)NC(=O)N[C@H]1CCOc2ccc(Br)cc21 ZINC000641473593 567437756 /nfs/dbraw/zinc/43/77/56/567437756.db2.gz ZVPVCGPYINFBGB-DOMZBBRYSA-N 1 1 384.318 3.301 10 0 GGAEMO CN(CC[N@@H+](C)C1CCN(C)CC1)C(=O)c1sc2ncccc2c1Cl ZINC000528562855 567439060 /nfs/dbraw/zinc/43/90/60/567439060.db2.gz ZZESYASQUKTKAH-UHFFFAOYSA-N 1 1 380.945 3.048 10 0 GGAEMO CN(CCN(C)C1CC[NH+](C)CC1)C(=O)c1sc2ncccc2c1Cl ZINC000528562855 567439067 /nfs/dbraw/zinc/43/90/67/567439067.db2.gz ZZESYASQUKTKAH-UHFFFAOYSA-N 1 1 380.945 3.048 10 0 GGAEMO COc1cccc(C[C@@H](C)NC(=O)[C@@H]([NH3+])c2ccccc2Br)c1 ZINC000662460406 567439611 /nfs/dbraw/zinc/43/96/11/567439611.db2.gz IQMZQWCUDYZKQL-PXAZEXFGSA-N 1 1 377.282 3.205 10 0 GGAEMO [NH3+][C@@H](C(=O)N1CCO[C@@H](c2ccsc2)C1)c1ccccc1Br ZINC000662499526 567441160 /nfs/dbraw/zinc/44/11/60/567441160.db2.gz UOFVEDKHTRMLLF-HUUCEWRRSA-N 1 1 381.295 3.111 10 0 GGAEMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)c2cc(=O)[nH]c3ccc(Br)cc32)C1 ZINC000457115201 567441274 /nfs/dbraw/zinc/44/12/74/567441274.db2.gz KTPNWJWCSLHTHZ-ZDUSSCGKSA-N 1 1 392.297 3.258 10 0 GGAEMO CC(C)Oc1cc(Br)cc(NC(=O)c2c[nH]nc2[C@H]2CC[NH2+]C2)c1 ZINC000662490665 567441528 /nfs/dbraw/zinc/44/15/28/567441528.db2.gz IOSGHGXAHOXIKB-NSHDSACASA-N 1 1 393.285 3.289 10 0 GGAEMO Cc1n[nH]c(C)c1[C@@H]1CCCN1C(=O)c1sc2c(c1Br)C[NH2+]C2 ZINC000662509850 567442707 /nfs/dbraw/zinc/44/27/07/567442707.db2.gz SDTBAHIBZAKBPC-NSHDSACASA-N 1 1 395.326 3.431 10 0 GGAEMO Cn1cc([C@@H](NC(=O)c2sc3c(c2Br)C[NH2+]C3)C(C)(C)C)cn1 ZINC000662500196 567443385 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10 0 GGAEMO O=C(Nc1ccc(Br)cc1F)N1CC[NH2+]C[C@@H]1c1cccnc1 ZINC000569939960 567445043 /nfs/dbraw/zinc/44/50/43/567445043.db2.gz DENONUKYUXGFTH-OAHLLOKOSA-N 1 1 379.233 3.162 10 0 GGAEMO C[N@@H+](CCCCNC(=O)Cc1c(F)ccc(Br)c1F)C1CC1 ZINC000457164273 567445469 /nfs/dbraw/zinc/44/54/69/567445469.db2.gz IMVAGLBOAWLHTG-UHFFFAOYSA-N 1 1 375.257 3.260 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCC[C@@H](OCC2CC2)C1 ZINC000662534645 567446301 /nfs/dbraw/zinc/44/63/01/567446301.db2.gz MTPZDYGJVAGOOF-LLVKDONJSA-N 1 1 385.327 3.145 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)C(C)(C)c3ccc(Br)cc3)[C@H]2C1 ZINC000502663664 567446474 /nfs/dbraw/zinc/44/64/74/567446474.db2.gz XJOKGTVGTCMQHA-DLBZAZTESA-N 1 1 395.341 3.048 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc(Cl)c(Br)c3)[C@H]2C1 ZINC000502680376 567446599 /nfs/dbraw/zinc/44/65/99/567446599.db2.gz QFVLABUGGZKSKE-LSDHHAIUSA-N 1 1 387.705 3.038 10 0 GGAEMO CC[N@H+]1CC[C@H]2OCCN(C(=O)c3ccc(Br)cc3Cl)[C@H]2C1 ZINC000502668363 567447015 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C[N@@H+]1CC[C@H](NS(=O)(=O)c2ccc(Br)cc2)[C@H]1c1ccccc1 ZINC000550490216 567450214 /nfs/dbraw/zinc/45/02/14/567450214.db2.gz DUFAWESFXFZZDS-DLBZAZTESA-N 1 1 395.322 3.173 10 0 GGAEMO C[N@H+]1CC[C@H](NS(=O)(=O)c2ccc(Br)cc2)[C@H]1c1ccccc1 ZINC000550490216 567450217 /nfs/dbraw/zinc/45/02/17/567450217.db2.gz DUFAWESFXFZZDS-DLBZAZTESA-N 1 1 395.322 3.173 10 0 GGAEMO CC1([NH+]2CCOCC2)CCN(Cc2nc3ccc(Br)cc3[nH]2)CC1 ZINC000528726371 567451634 /nfs/dbraw/zinc/45/16/34/567451634.db2.gz IFFMXYAHVJPGIH-UHFFFAOYSA-N 1 1 393.329 3.012 10 0 GGAEMO CC1(N2CCOCC2)CC[NH+](Cc2nc3ccc(Br)cc3o2)CC1 ZINC000528726303 567451818 /nfs/dbraw/zinc/45/18/18/567451818.db2.gz FZLUBKKXDQHTPZ-UHFFFAOYSA-N 1 1 394.313 3.277 10 0 GGAEMO C[C@@H]1CCC[C@H](C)[N@@H+]1CCNS(=O)(=O)c1ccc(F)cc1C(F)(F)F ZINC000594030827 567453590 /nfs/dbraw/zinc/45/35/90/567453590.db2.gz SFEVGRUNKPHOIF-TXEJJXNPSA-N 1 1 382.423 3.386 10 0 GGAEMO C[C@@H](NC(=O)C[N@@H+]1CC[C@H]2CC[C@@H](C1)[S@@]2=O)c1ccc(Cl)c(Cl)c1 ZINC000528785542 567456448 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IYPXRMOFZWSNRD-ZIVIXCLASA-N 1 1 399.354 3.070 10 0 GGAEMO Cc1cc(NC(=O)[C@H](C)[N@H+]2CC[C@H]3CC[C@@H](C2)[S@]3=O)ccc1Br ZINC000528784085 567457081 /nfs/dbraw/zinc/45/70/81/567457081.db2.gz IYPXRMOFZWSNRD-ZIVIXCLASA-N 1 1 399.354 3.070 10 0 GGAEMO C[NH2+][C@H](C(=O)N1CCOc2ccc(O)cc2C1)c1cccc(Cl)c1Cl ZINC000662735821 567459594 /nfs/dbraw/zinc/45/95/94/567459594.db2.gz QKAMTOYODVOFNC-KRWDZBQOSA-N 1 1 381.259 3.381 10 0 GGAEMO COC(=O)[C@H]([NH2+]CCCC(=O)Nc1c(C)cc(Br)cc1C)C1CC1 ZINC000502880051 567459681 /nfs/dbraw/zinc/45/96/81/567459681.db2.gz AYTLULUTKAFFCY-QGZVFWFLSA-N 1 1 397.313 3.326 10 0 GGAEMO CC(C)C[N@H+]1CC[C@H](CNC(=O)c2ccc(Br)c(F)c2F)C1 ZINC000528813397 567460189 /nfs/dbraw/zinc/46/01/89/567460189.db2.gz JEXVTICRLHBDNG-LLVKDONJSA-N 1 1 375.257 3.435 10 0 GGAEMO CC(C)(C(=O)N[C@@H]1CCc2nc[nH]c2C1)[C@H](O)c1cc(Cl)cc(Cl)c1 ZINC000528870622 567463837 /nfs/dbraw/zinc/46/38/37/567463837.db2.gz KTTXIUCCXOYJOE-CZUORRHYSA-N 1 1 382.291 3.450 10 0 GGAEMO O=C(c1sc2c(c1Br)C[NH2+]C2)N1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000662826270 567463957 /nfs/dbraw/zinc/46/39/57/567463957.db2.gz YJBLJCDUTWLOSS-VXGBXAGGSA-N 1 1 399.354 3.393 10 0 GGAEMO CC(C)(C(=O)N[C@@H]1CCc2nc[nH]c2C1)[C@@H](O)c1cc(Cl)cc(Cl)c1 ZINC000528870620 567463974 /nfs/dbraw/zinc/46/39/74/567463974.db2.gz KTTXIUCCXOYJOE-CJNGLKHVSA-N 1 1 382.291 3.450 10 0 GGAEMO CCN1CC[NH+](CC(C)(C)NC(=O)NCc2ccc(Cl)cc2Cl)CC1 ZINC000457415011 567464203 /nfs/dbraw/zinc/46/42/03/567464203.db2.gz MISJECJCCSZQAI-UHFFFAOYSA-N 1 1 387.355 3.209 10 0 GGAEMO COCC[N@H+]1CCC[C@H]1CNC(=O)N[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000503026638 567464962 /nfs/dbraw/zinc/46/49/62/567464962.db2.gz NYLNMGJGCOIFJQ-LRDDRELGSA-N 1 1 386.323 3.391 10 0 GGAEMO CC[N@H+]1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)[C@H]1C[C@@]1(C)Br ZINC000528905279 567467461 /nfs/dbraw/zinc/46/74/61/567467461.db2.gz YCHIPZYJPULLQQ-SZVBFZGTSA-N 1 1 395.341 3.379 10 0 GGAEMO CC1(C)C[NH+](CC(=O)N2CCC[C@@H]2c2ccccc2I)C1 ZINC000594290702 567468262 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CSc1c(C(=O)NC[C@H](c2cccc(Cl)c2)[NH+]2CCCC2)cnn1C ZINC000478685991 567475850 /nfs/dbraw/zinc/47/58/50/567475850.db2.gz HRDNCRZVOFASCV-MRXNPFEDSA-N 1 1 378.929 3.362 10 0 GGAEMO Cc1sc2nc(C)nc(NC[C@@]3([NH+]4CCOCC4)CCSC3)c2c1C ZINC000642328540 567476039 /nfs/dbraw/zinc/47/60/39/567476039.db2.gz VOLITLVLNXLDEH-SFHVURJKSA-N 1 1 378.567 3.236 10 0 GGAEMO C[C@@H]1CCCN(S(=O)(=O)NC[C@@H](c2cccc(Cl)c2)[NH+]2CCCC2)C1 ZINC000642335324 567476252 /nfs/dbraw/zinc/47/62/52/567476252.db2.gz VRBVWZKBYDOMRT-QAPCUYQASA-N 1 1 385.961 3.043 10 0 GGAEMO COc1cccc([C@H](CNS(=O)(=O)c2cccc(Cl)c2C)[NH+](C)C)c1 ZINC000642375721 567477250 /nfs/dbraw/zinc/47/72/50/567477250.db2.gz OJZGKWJGIYFLBP-KRWDZBQOSA-N 1 1 382.913 3.238 10 0 GGAEMO CC(=O)NCC[N@@H+](Cc1ccc(Br)s1)C[C@@H]1CCO[C@H](C)C1 ZINC000503248355 567477518 /nfs/dbraw/zinc/47/75/18/567477518.db2.gz YVQDEJLTEJPFNW-TZMCWYRMSA-N 1 1 389.359 3.264 10 0 GGAEMO CC(=O)NCC[N@@H+](Cc1ccc(Br)s1)C[C@H]1CCO[C@H](C)C1 ZINC000503248354 567477579 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C[N@H+]1CC[C@H](NC(=O)C(=O)c2ccc(Br)cc2)[C@H]1c1ccccc1 ZINC000534018900 567797157 /nfs/dbraw/zinc/79/71/57/567797157.db2.gz GMMDBMQIXHLFJY-DLBZAZTESA-N 1 1 387.277 3.193 10 0 GGAEMO CC[N@H+]1CCC[C@H](CNC(=O)NCc2ccc(Br)c(F)c2F)C1 ZINC000624708086 567797387 /nfs/dbraw/zinc/79/73/87/567797387.db2.gz VHCPEPXRHPQGRY-LLVKDONJSA-N 1 1 390.272 3.258 10 0 GGAEMO O=C(NCc1cc(F)c(Br)cc1F)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000624705481 567797447 /nfs/dbraw/zinc/79/74/47/567797447.db2.gz NMSKBMYJCVQWKH-NWDGAFQWSA-N 1 1 388.256 3.153 10 0 GGAEMO CC(C)[N@H+]1CC[C@H](CNC(=O)[C@@H]2[C@@H]3Cc4c(cccc4Br)[C@@H]32)C1 ZINC000624732705 567798127 /nfs/dbraw/zinc/79/81/27/567798127.db2.gz DTCJSBRQNKKOJA-ZYRRHWMLSA-N 1 1 377.326 3.181 10 0 GGAEMO CC[N@@H+](CCNC(=O)c1c(F)c(F)c(Br)c(F)c1F)C1CC1 ZINC000668151975 567798015 /nfs/dbraw/zinc/79/80/15/567798015.db2.gz VMAYWHNYIXTDRX-UHFFFAOYSA-N 1 1 383.183 3.220 10 0 GGAEMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1c(F)cccc1I ZINC000598889622 567798117 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CCOC(=O)c1ccc(N2CC([NH2+]Cc3ccsc3Br)C2)nc1 ZINC000598971731 567800993 /nfs/dbraw/zinc/80/09/93/567800993.db2.gz CIJGFWXIQCDHOL-UHFFFAOYSA-N 1 1 396.310 3.061 10 0 GGAEMO Fc1ccc(I)c(F)c1C[NH2+][C@H]1CO[C@H](C2CC2)C1 ZINC000599009908 567803143 /nfs/dbraw/zinc/80/31/43/567803143.db2.gz ONFBOMLPBUPJIM-RNCFNFMXSA-N 1 1 379.188 3.227 10 0 GGAEMO C[N@H+]1CCC[C@@H]1[C@H]1COCCN1C(=O)Cc1csc2ccc(Cl)cc12 ZINC000647821776 567803363 /nfs/dbraw/zinc/80/33/63/567803363.db2.gz MBDINRWAENBGIO-IAGOWNOFSA-N 1 1 378.925 3.419 10 0 GGAEMO C[N@H+]1CCC[C@H]1[C@H]1COCCN1C(=O)Cc1csc2ccc(Cl)cc12 ZINC000647821775 567803396 /nfs/dbraw/zinc/80/33/96/567803396.db2.gz MBDINRWAENBGIO-DLBZAZTESA-N 1 1 378.925 3.419 10 0 GGAEMO CCC(F)(F)C(C)(C)CS(=O)(=O)NC[C@@H](c1ccc(F)cc1)[NH+](C)C ZINC000624875075 567803563 /nfs/dbraw/zinc/80/35/63/567803563.db2.gz DPXDYFHFAVKCOR-HNNXBMFYSA-N 1 1 380.476 3.419 10 0 GGAEMO Cc1noc([C@H]2OCC[C@H]2[NH2+][C@H](C)c2ccccc2I)n1 ZINC000599093571 567805501 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O=C(COc1ccc(-c2ccccc2)cc1)N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000023717557 570370092 /nfs/dbraw/zinc/37/00/92/570370092.db2.gz HENZLLDYTAZDBO-JOCHJYFZSA-N 1 1 380.488 3.056 10 0 GGAEMO COc1ccc(-c2nc3c([nH]2)C[N@H+](Cc2cnn(-c4ccccc4)c2)CC3)cn1 ZINC000220187402 570383459 /nfs/dbraw/zinc/38/34/59/570383459.db2.gz HCRRXKVIBQQVOT-UHFFFAOYSA-N 1 1 386.459 3.224 10 0 GGAEMO COc1ccc(-c2nc3c([nH]2)C[N@@H+](Cc2cnn(-c4ccccc4)c2)CC3)cn1 ZINC000220187402 570383461 /nfs/dbraw/zinc/38/34/61/570383461.db2.gz HCRRXKVIBQQVOT-UHFFFAOYSA-N 1 1 386.459 3.224 10 0 GGAEMO CCn1c(SCC(=O)N2CC[NH+]([C@H](C)c3ccccc3)CC2)nnc1C1CC1 ZINC000024422185 570383536 /nfs/dbraw/zinc/38/35/36/570383536.db2.gz LGOVMFMVYPFDEZ-MRXNPFEDSA-N 1 1 399.564 3.173 10 0 GGAEMO C[N@@H+](CCCNC(=O)Cn1c2ccccc2n2cccc2c1=O)C1CCCCC1 ZINC000006782347 570386214 /nfs/dbraw/zinc/38/62/14/570386214.db2.gz WUKQDNJVBVHLCQ-UHFFFAOYSA-N 1 1 394.519 3.025 10 0 GGAEMO CC(=O)N[C@H](CC(=O)NCc1cccc(Cn2cc[nH+]c2C)c1)c1ccccc1 ZINC000024754476 570391598 /nfs/dbraw/zinc/39/15/98/570391598.db2.gz CMGAOZDJOYVEOD-JOCHJYFZSA-N 1 1 390.487 3.124 10 0 GGAEMO CC(=O)N[C@@H](CC(=O)NCc1cccc(Cn2cc[nH+]c2C)c1)c1ccccc1 ZINC000024754472 570391616 /nfs/dbraw/zinc/39/16/16/570391616.db2.gz CMGAOZDJOYVEOD-QFIPXVFZSA-N 1 1 390.487 3.124 10 0 GGAEMO C[C@@H](C(=O)NCc1ccc2c(c1)OCO2)[N@H+](C)Cc1ccc(OC(F)F)cc1 ZINC000024819931 570394113 /nfs/dbraw/zinc/39/41/13/570394113.db2.gz YMDYJWKQJQGHNZ-ZDUSSCGKSA-N 1 1 392.402 3.153 10 0 GGAEMO C[C@@H](C(=O)NCc1ccc2c(c1)OCO2)[N@@H+](C)Cc1ccc(OC(F)F)cc1 ZINC000024819931 570394116 /nfs/dbraw/zinc/39/41/16/570394116.db2.gz YMDYJWKQJQGHNZ-ZDUSSCGKSA-N 1 1 392.402 3.153 10 0 GGAEMO C[N@H+](CCC(=O)Nc1ccnn1C1CCCC1)CC(=O)Nc1cccc(F)c1 ZINC000024924145 570398519 /nfs/dbraw/zinc/39/85/19/570398519.db2.gz QVHKZZHFWQQOGP-UHFFFAOYSA-N 1 1 387.459 3.036 10 0 GGAEMO C[N@@H+](CCC(=O)Nc1ccnn1C1CCCC1)CC(=O)Nc1cccc(F)c1 ZINC000024924145 570398522 /nfs/dbraw/zinc/39/85/22/570398522.db2.gz QVHKZZHFWQQOGP-UHFFFAOYSA-N 1 1 387.459 3.036 10 0 GGAEMO Cc1ccc(CN(C)C(=O)CN2CCC[N@@H+](Cc3ccc(C)cc3)CC2)cc1 ZINC000024972484 570400556 /nfs/dbraw/zinc/40/05/56/570400556.db2.gz ZWARVIZWTCVVRX-UHFFFAOYSA-N 1 1 379.548 3.470 10 0 GGAEMO O[C@H](COCc1ccc2c(c1)OCO2)C[NH+](Cc1ccco1)Cc1ccco1 ZINC000025228661 570408562 /nfs/dbraw/zinc/40/85/62/570408562.db2.gz VKUFCQXSXBUBHR-KRWDZBQOSA-N 1 1 385.416 3.181 10 0 GGAEMO C[N@@H+](Cc1nc2ccccc2s1)C[C@H](O)COCc1ccc2c(c1)OCO2 ZINC000025233283 570409020 /nfs/dbraw/zinc/40/90/20/570409020.db2.gz SJZDONQQOVLVIO-HNNXBMFYSA-N 1 1 386.473 3.035 10 0 GGAEMO C[N@H+](Cc1nc2ccccc2s1)C[C@H](O)COCc1ccc2c(c1)OCO2 ZINC000025233283 570409023 /nfs/dbraw/zinc/40/90/23/570409023.db2.gz SJZDONQQOVLVIO-HNNXBMFYSA-N 1 1 386.473 3.035 10 0 GGAEMO Cc1ccc(/C=C/C(=O)NCCCC(=O)N2CCC([N@H+](C)C(C)C)CC2)cc1 ZINC000005135293 570423995 /nfs/dbraw/zinc/42/39/95/570423995.db2.gz SKEHFHHKKZHOJX-VAWYXSNFSA-N 1 1 385.552 3.236 10 0 GGAEMO C[C@H](NC(=O)c1ccccc1Cl)C(=O)N1CCC[N@@H+](Cc2ccccc2)CC1 ZINC000026356289 570424787 /nfs/dbraw/zinc/42/47/87/570424787.db2.gz IBROCDRJQGQQIF-KRWDZBQOSA-N 1 1 399.922 3.193 10 0 GGAEMO CC(C)[N@@H+](CCCNC(=O)Cn1cc2c(n1)CC[C@H](C)C2)Cc1ccccc1 ZINC000005148605 570427712 /nfs/dbraw/zinc/42/77/12/570427712.db2.gz ZUIGAUCRCSSRLR-IBGZPJMESA-N 1 1 382.552 3.425 10 0 GGAEMO CCOc1ccc(S(=O)(=O)N2CCC(C[N@H+]3CCC[C@@H](C)C3)CC2)cc1 ZINC000032952025 570428391 /nfs/dbraw/zinc/42/83/91/570428391.db2.gz KWEDPZYRSOJOOK-QGZVFWFLSA-N 1 1 380.554 3.218 10 0 GGAEMO CC(=O)c1ccc(S(=O)(=O)N2CCC(C[N@@H+]3CCC[C@@H](C)C3)CC2)cc1 ZINC000032952047 570428684 /nfs/dbraw/zinc/42/86/84/570428684.db2.gz POYLTFXKJGGIFQ-MRXNPFEDSA-N 1 1 378.538 3.022 10 0 GGAEMO O=C(C[N@@H+]1CCC[C@H]1Cc1cccc(F)c1)NC[C@H]1CCN(c2ccccc2)C1 ZINC000239782528 570430730 /nfs/dbraw/zinc/43/07/30/570430730.db2.gz COYOGQYZBOFXBL-OFNKIYASSA-N 1 1 395.522 3.475 10 0 GGAEMO CC(C)[C@H]1CN(C(=O)[C@H]2CC[C@@H](O)CC2)CCC[N@H+]1Cc1ccc(F)cc1 ZINC000244874465 570433982 /nfs/dbraw/zinc/43/39/82/570433982.db2.gz XBTIPTGDNOGTIC-HLAWJBBLSA-N 1 1 376.516 3.436 10 0 GGAEMO CCC[N@H+](Cc1c(-c2ccccc2)noc1N1CCN(C)CC1)C[C@@H](O)CC ZINC000035781191 570448446 /nfs/dbraw/zinc/44/84/46/570448446.db2.gz IINZNVBKRSLACC-IBGZPJMESA-N 1 1 386.540 3.076 10 0 GGAEMO CC(C)CNC(=O)[C@H]1Cc2ccccc2N2CC[N@@H+](Cc3ccc(F)cc3)C[C@H]12 ZINC000035894112 570474436 /nfs/dbraw/zinc/47/44/36/570474436.db2.gz ATJSGHZSKHAGRG-JTHBVZDNSA-N 1 1 395.522 3.461 10 0 GGAEMO C[C@@H]1CN(Cc2ccc(F)cc2)CC[N@H+]1CCC(=O)Nc1cc(N)ccc1F ZINC000252536531 570477997 /nfs/dbraw/zinc/47/79/97/570477997.db2.gz IUUCUDXQMKZJBD-OAHLLOKOSA-N 1 1 388.462 3.082 10 0 GGAEMO Cc1ccc(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](Oc3cccnc3N(C)C)C2)cc1F ZINC000253427195 570483239 /nfs/dbraw/zinc/48/32/39/570483239.db2.gz DORMKVKLVIABCW-NVXWUHKLSA-N 1 1 386.471 3.075 10 0 GGAEMO Cc1ccc(NC(=O)[C@@H](C)[N@H+]2CC[C@@H](Oc3cccnc3N(C)C)C2)cc1F ZINC000253427195 570483242 /nfs/dbraw/zinc/48/32/42/570483242.db2.gz DORMKVKLVIABCW-NVXWUHKLSA-N 1 1 386.471 3.075 10 0 GGAEMO CCOC(=O)C1=C(C[NH+]2CCC(C)CC2)N(C)C(=O)N[C@@H]1c1ccccc1C ZINC000035991336 570505389 /nfs/dbraw/zinc/50/53/89/570505389.db2.gz MNAZIZUVKIWGFP-HXUWFJFHSA-N 1 1 385.508 3.240 10 0 GGAEMO CCOC(=O)C1=C(C[N@H+]2CCCC[C@@H]2C)N(C)C(=O)N[C@H]1c1cccc(C)c1 ZINC000035991681 570505780 /nfs/dbraw/zinc/50/57/80/570505780.db2.gz VGZPKLYCEBZRLV-JXFKEZNVSA-N 1 1 385.508 3.383 10 0 GGAEMO CC(=O)Nc1nc2ccc(CC(=O)NCCC[N@@H+]3CCCC[C@@H]3C)cc2s1 ZINC000032959582 570515897 /nfs/dbraw/zinc/51/58/97/570515897.db2.gz MXDDNHQARQYQFT-AWEZNQCLSA-N 1 1 388.537 3.178 10 0 GGAEMO COC[C@@H](C)[NH+]1CCN([C@H](C)C(=O)Nc2ccccc2-c2ccccc2)CC1 ZINC000072308084 570525673 /nfs/dbraw/zinc/52/56/73/570525673.db2.gz KDNYCJJWUGIDAJ-RTBURBONSA-N 1 1 381.520 3.333 10 0 GGAEMO COC[C@@H](C)[NH+]1CCN([C@@H](C)C(=O)Nc2ccccc2-c2ccccc2)CC1 ZINC000072308082 570525885 /nfs/dbraw/zinc/52/58/85/570525885.db2.gz KDNYCJJWUGIDAJ-MOPGFXCFSA-N 1 1 381.520 3.333 10 0 GGAEMO COC[C@H](C)[NH+]1CCN([C@H](C)C(=O)Nc2ccccc2-c2ccccc2)CC1 ZINC000072308083 570525895 /nfs/dbraw/zinc/52/58/95/570525895.db2.gz KDNYCJJWUGIDAJ-RBUKOAKNSA-N 1 1 381.520 3.333 10 0 GGAEMO COCCNC(=O)c1coc(C[N@H+](Cc2cccc(OC)c2)[C@H](C)C(C)C)n1 ZINC000036065577 570526168 /nfs/dbraw/zinc/52/61/68/570526168.db2.gz ZKTHKOUCBLIMIM-MRXNPFEDSA-N 1 1 389.496 3.106 10 0 GGAEMO COCCNC(=O)c1coc(C[N@@H+](Cc2cccc(OC)c2)[C@H](C)C(C)C)n1 ZINC000036065577 570526173 /nfs/dbraw/zinc/52/61/73/570526173.db2.gz ZKTHKOUCBLIMIM-MRXNPFEDSA-N 1 1 389.496 3.106 10 0 GGAEMO O[C@@H](CS[C@H](C[C@H](O)c1ccccc1)c1ccccc1)C[NH+]1CCOCC1 ZINC000033636731 570527977 /nfs/dbraw/zinc/52/79/77/570527977.db2.gz PBOCNDYMWLNMNQ-BHIFYINESA-N 1 1 387.545 3.278 10 0 GGAEMO CCC[N@H+](Cc1ccc(OC)c(OC)c1)C[C@@H](O)COc1ccc(OC)cc1 ZINC000036095967 570535458 /nfs/dbraw/zinc/53/54/58/570535458.db2.gz LEWOVYLBLQSUKA-GOSISDBHSA-N 1 1 389.492 3.364 10 0 GGAEMO COc1cccc(C[N@@H+](CC(C)C)C[C@H](O)COCc2ccco2)c1OC ZINC000036097051 570535540 /nfs/dbraw/zinc/53/55/40/570535540.db2.gz JOTCXVQGRORTPM-SFHVURJKSA-N 1 1 377.481 3.333 10 0 GGAEMO COc1cccc(C[N@@H+](CC(C)C)C[C@@H](O)COCc2ccco2)c1OC ZINC000036097053 570535624 /nfs/dbraw/zinc/53/56/24/570535624.db2.gz JOTCXVQGRORTPM-GOSISDBHSA-N 1 1 377.481 3.333 10 0 GGAEMO Cc1ccc(C[N@H+](Cc2ccc3c(c2)OCO3)C[C@H](O)COCC(C)C)o1 ZINC000036097811 570535986 /nfs/dbraw/zinc/53/59/86/570535986.db2.gz BOSHRWRUWWPNMS-SFHVURJKSA-N 1 1 375.465 3.352 10 0 GGAEMO Cc1ccc(C[N@@H+](Cc2ccc3c(c2)OCO3)C[C@H](O)COCC(C)C)o1 ZINC000036097811 570535987 /nfs/dbraw/zinc/53/59/87/570535987.db2.gz BOSHRWRUWWPNMS-SFHVURJKSA-N 1 1 375.465 3.352 10 0 GGAEMO COCCC[N@H+](Cc1ccc(F)cc1F)C[C@H](O)COc1ccc(OC)cc1 ZINC000036099713 570538180 /nfs/dbraw/zinc/53/81/80/570538180.db2.gz XGKSATLEYOUDLZ-SFHVURJKSA-N 1 1 395.446 3.252 10 0 GGAEMO COC[C@H](O)C[N@H+](Cc1ccccc1)C[C@@H]1CC(c2ccc(Cl)cc2)=NO1 ZINC000036146542 570549614 /nfs/dbraw/zinc/54/96/14/570549614.db2.gz ZJVZTHUDMZHKBW-UXHICEINSA-N 1 1 388.895 3.343 10 0 GGAEMO CC[N@@H+](Cc1nc(=O)c2c3c(sc2[nH]1)CCCC3)C[C@H](O)Cc1ccccc1 ZINC000036160885 570555985 /nfs/dbraw/zinc/55/59/85/570555985.db2.gz NANVBNLEISVFRA-MRXNPFEDSA-N 1 1 397.544 3.289 10 0 GGAEMO CC[N@H+](Cc1nc(=O)c2c3c(sc2[nH]1)CCCC3)C[C@H](O)Cc1ccccc1 ZINC000036160885 570555988 /nfs/dbraw/zinc/55/59/88/570555988.db2.gz NANVBNLEISVFRA-MRXNPFEDSA-N 1 1 397.544 3.289 10 0 GGAEMO C[C@@H]1CCC[N@@H+](CCCNC(=O)CC2CCN(C(=O)C3CCCCC3)CC2)C1 ZINC000032974393 570562215 /nfs/dbraw/zinc/56/22/15/570562215.db2.gz YHXIXRFCVQQABI-LJQANCHMSA-N 1 1 391.600 3.434 10 0 GGAEMO Cc1ccc(C(=O)N2CCC(CC(=O)NCC[N@@H+]3CCCC[C@@H]3C)CC2)cc1 ZINC000032974205 570562778 /nfs/dbraw/zinc/56/27/78/570562778.db2.gz HJLAYXBJGWVOQW-IBGZPJMESA-N 1 1 385.552 3.228 10 0 GGAEMO Cc1ccc(C(=O)N2CCC(CC(=O)NCCC[N@@H+]3CCC[C@@H](C)C3)CC2)cc1 ZINC000032974208 570562825 /nfs/dbraw/zinc/56/28/25/570562825.db2.gz REQUZGMZVPIALK-HXUWFJFHSA-N 1 1 399.579 3.476 10 0 GGAEMO c1coc(-c2noc(C[NH+]3CCC4(C[C@H]4c4nnc5n4CCCCC5)CC3)n2)c1 ZINC000071890595 570575049 /nfs/dbraw/zinc/57/50/49/570575049.db2.gz VFLLGZNTTHZISC-HNNXBMFYSA-N 1 1 394.479 3.417 10 0 GGAEMO CC(C)Cc1noc(C[NH+]2CCC3(C[C@H]3c3nnc4n3CCCCC4)CC2)n1 ZINC000071890617 570575113 /nfs/dbraw/zinc/57/51/13/570575113.db2.gz FENGZAZJHJRSRI-INIZCTEOSA-N 1 1 384.528 3.356 10 0 GGAEMO CCCC[N@@H+](CC)CCCNC(=O)c1cc2c(c3ccccc3[nH]c2=O)n1C ZINC000006771859 570581962 /nfs/dbraw/zinc/58/19/62/570581962.db2.gz UMXREJHXNWMKGK-UHFFFAOYSA-N 1 1 382.508 3.262 10 0 GGAEMO CCN(CC)C(=O)[C@H](C1CCCC1)[NH+]1CCN(C(=O)c2ccccc2C)CC1 ZINC000036250144 570585292 /nfs/dbraw/zinc/58/52/92/570585292.db2.gz UUUKKYCDBABRQE-NRFANRHFSA-N 1 1 385.552 3.180 10 0 GGAEMO C[C@@H]1CCCCN1C(=O)[C@H](C1CCCC1)[NH+]1CCN(C(=O)c2ccccc2)CC1 ZINC000036250227 570585361 /nfs/dbraw/zinc/58/53/61/570585361.db2.gz QEDKXPOOJYDUEX-KNQAVFIVSA-N 1 1 397.563 3.404 10 0 GGAEMO CCCN(C)C(=O)[C@H](C1CCCC1)[NH+]1CCN(C(=O)c2cccc(F)c2)CC1 ZINC000036250743 570587571 /nfs/dbraw/zinc/58/75/71/570587571.db2.gz LQFAKISXWSMGIU-FQEVSTJZSA-N 1 1 389.515 3.011 10 0 GGAEMO CC[N@@H+](CC(=O)N1CCC(C)CC1)[C@H]1CCCN(C(=O)OC(C)(C)C)CC1 ZINC000225670144 570600953 /nfs/dbraw/zinc/60/09/53/570600953.db2.gz NQTKYYQXBOQWAB-SFHVURJKSA-N 1 1 381.561 3.356 10 0 GGAEMO CC(C)CNC(=O)[C@@H]1Cc2ccccc2N2CC[N@@H+](CCc3ccccc3)C[C@@H]12 ZINC000169680429 570601641 /nfs/dbraw/zinc/60/16/41/570601641.db2.gz OQSNJTBOUXXRGX-VWNXMTODSA-N 1 1 391.559 3.364 10 0 GGAEMO CC[C@@H](C)[N@H+](Cc1ccc(OC)c(OC)c1)C[C@@H](O)COCc1ccco1 ZINC000169681675 570602316 /nfs/dbraw/zinc/60/23/16/570602316.db2.gz LLCBFTLQGJPFNA-SJLPKXTDSA-N 1 1 377.481 3.475 10 0 GGAEMO CC[C@H](C)[N@H+](Cc1ccc(OC)c(OC)c1)C[C@@H](O)COCc1ccco1 ZINC000169681676 570602324 /nfs/dbraw/zinc/60/23/24/570602324.db2.gz LLCBFTLQGJPFNA-FUHWJXTLSA-N 1 1 377.481 3.475 10 0 GGAEMO CC(C)NC(=O)[C@H](C1CCCC1)[NH+]1CCN(C(=O)Nc2ccc(F)cc2)CC1 ZINC000036310432 570608937 /nfs/dbraw/zinc/60/89/37/570608937.db2.gz ILPLIZYPPMSCQA-IBGZPJMESA-N 1 1 390.503 3.059 10 0 GGAEMO C[N@@H+](CCCNC(=O)c1cc(=O)n2c3ccccc3nc2s1)C1CCCCC1 ZINC000033008876 570620299 /nfs/dbraw/zinc/62/02/99/570620299.db2.gz 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376.522 3.400 10 0 GGAEMO O=C(COCc1cc(-c2cccs2)on1)N1CC[NH+](Cc2ccccc2)CC1 ZINC000020531678 1399347968 /nfs/dbraw/zinc/34/79/68/1399347968.db2.gz RKQUQYZJWWLSGM-UHFFFAOYSA-N 1 1 397.500 3.264 10 0 GGAEMO c1cc(CNCCC[NH+]2CCCCCC2)n(-c2nnc(N3CCCC3)s2)c1 ZINC000020576552 1399349469 /nfs/dbraw/zinc/34/94/69/1399349469.db2.gz SLFGZFSOQDVOEW-UHFFFAOYSA-N 1 1 388.585 3.285 10 0 GGAEMO CCOc1ccc(NC(=O)N(CCC[NH+]2CCOCC2)Cc2cccnc2)cc1 ZINC000020685557 1399351962 /nfs/dbraw/zinc/35/19/62/1399351962.db2.gz WLMNCKHIAOUWMJ-UHFFFAOYSA-N 1 1 398.507 3.237 10 0 GGAEMO CC[C@H]1CCCC[N@H+]1CCCNC(=O)C[C@@H]1Sc2ccccc2NC1=O ZINC000020726351 1399352216 /nfs/dbraw/zinc/35/22/16/1399352216.db2.gz ZGDHEOYRFAQULK-YJBOKZPZSA-N 1 1 375.538 3.260 10 0 GGAEMO C[N@@H+]1CC=C(c2noc(CCC(=O)N3CC=C(c4ccccc4)CC3)n2)CC1 ZINC000020901795 1399356842 /nfs/dbraw/zinc/35/68/42/1399356842.db2.gz VUQZZNHFDCQZHG-UHFFFAOYSA-N 1 1 378.476 3.037 10 0 GGAEMO COc1ccc(-c2noc(CC(=O)NCCC[N@@H+]3[C@H](C)CCC[C@@H]3C)n2)cc1 ZINC000020921535 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390.439 3.382 10 0 GGAEMO O=C(NCc1ccc(C[NH+]2CCOCC2)cc1)N[C@H]1CCCc2ccccc21 ZINC000022437432 1399464246 /nfs/dbraw/zinc/46/42/46/1399464246.db2.gz YKDBTFALEZPXSM-QFIPXVFZSA-N 1 1 379.504 3.396 10 0 GGAEMO C/C(C=NNC(=O)CN1CC[NH+](Cc2ccccc2)CC1)=C\c1ccccc1 ZINC000022591593 1399480750 /nfs/dbraw/zinc/48/07/50/1399480750.db2.gz GENVOGWSQGWTED-TZGBAESGSA-N 1 1 376.504 3.010 10 0 GGAEMO S=C(NCCC[NH+]1CCOCC1)Nc1cccc(/C=C/c2ccccn2)c1 ZINC000025784546 1399836114 /nfs/dbraw/zinc/83/61/14/1399836114.db2.gz KHLYPJGQJRHLGT-CMDGGOBGSA-N 1 1 382.533 3.261 10 0 GGAEMO Cc1ccc(C(=O)NC2CC2)cc1NC(=O)N1CC[NH+](Cc2ccccc2)CC1 ZINC000047987834 1405019262 /nfs/dbraw/zinc/01/92/62/1405019262.db2.gz BVNVRZSVQWSBCN-UHFFFAOYSA-N 1 1 392.503 3.237 10 0 GGAEMO CCOc1c(Br)cc(Br)cc1CN[C@H]1CC[N@H+](C)C1 ZINC000049084882 1405339775 /nfs/dbraw/zinc/33/97/75/1405339775.db2.gz CXJXQKKCPCMSRX-LBPRGKRZSA-N 1 1 392.135 3.404 10 0 GGAEMO CCOc1c(Br)cc(Br)cc1CN[C@H]1CC[N@@H+](C)C1 ZINC000049084882 1405339779 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395.503 3.056 10 0 GGAEMO CCCC(=O)NC[C@@H]1CCC[N@H+]([C@@H](C)C(=O)N2c3ccccc3CC[C@H]2C)C1 ZINC000245389017 1433457731 /nfs/dbraw/zinc/45/77/31/1433457731.db2.gz GGZIGRTZAOZDGG-QYZOEREBSA-N 1 1 385.552 3.371 10 0 GGAEMO CCC[N@@H+](C)C[C@H]1CCN([C@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000245413100 1433463218 /nfs/dbraw/zinc/46/32/18/1433463218.db2.gz BDUKTUNVGXISAC-WOJBJXKFSA-N 1 1 397.567 3.480 10 0 GGAEMO Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)[N@@H+](C)C[C@@H]1CCCC[C@H]1O ZINC000245527005 1433481365 /nfs/dbraw/zinc/48/13/65/1433481365.db2.gz AWAUOGSYBUJFIE-CMKODMSKSA-N 1 1 384.524 3.299 10 0 GGAEMO CC(C)OC(=O)c1ccc(NC(=O)[C@H](C)[N@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)cc1 ZINC000245557285 1433484805 /nfs/dbraw/zinc/48/48/05/1433484805.db2.gz ATRXPYDRROUYMO-FUHIMQAGSA-N 1 1 398.507 3.358 10 0 GGAEMO O[C@H](C[NH2+][C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1)COc1ccc(F)cc1 ZINC000245686841 1433499406 /nfs/dbraw/zinc/49/94/06/1433499406.db2.gz JREBFTMWWGENCC-CIAFKFPVSA-N 1 1 384.495 3.351 10 0 GGAEMO O[C@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1)COc1ccc(F)cc1 ZINC000245686841 1433499407 /nfs/dbraw/zinc/49/94/07/1433499407.db2.gz JREBFTMWWGENCC-CIAFKFPVSA-N 1 1 384.495 3.351 10 0 GGAEMO O[C@H](CN[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccccc1)COc1ccc(F)cc1 ZINC000245686841 1433499408 /nfs/dbraw/zinc/49/94/08/1433499408.db2.gz JREBFTMWWGENCC-CIAFKFPVSA-N 1 1 384.495 3.351 10 0 GGAEMO COC(=O)c1ccc(C)c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](Nc3ccccc3)C2)c1 ZINC000246001899 1433556679 /nfs/dbraw/zinc/55/66/79/1433556679.db2.gz FQCGZOJGEUPNRZ-QFBILLFUSA-N 1 1 381.476 3.295 10 0 GGAEMO COC(=O)c1ccc(C)c(NC(=O)[C@H](C)[N@H+]2CC[C@@H](Nc3ccccc3)C2)c1 ZINC000246001899 1433556682 /nfs/dbraw/zinc/55/66/82/1433556682.db2.gz FQCGZOJGEUPNRZ-QFBILLFUSA-N 1 1 381.476 3.295 10 0 GGAEMO C[C@H](C(=O)N1c2ccccc2CC[C@H]1C)[N@H+]1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000246063913 1433563499 /nfs/dbraw/zinc/56/34/99/1433563499.db2.gz ANEXWMYGJPMREL-ZHALLVOQSA-N 1 1 393.535 3.160 10 0 GGAEMO C[C@H](CNC(=O)[C@@H]1CCCC[C@H]1C(=O)N1CCCC1)[N@@H+](C)Cc1ccccc1 ZINC000246540808 1433628018 /nfs/dbraw/zinc/62/80/18/1433628018.db2.gz HXUZXMRCPAKTAO-HMXCVIKNSA-N 1 1 385.552 3.052 10 0 GGAEMO COCC[N@@H+]1[C@H](C)CN([C@H](C)C(=O)N[C@H](C)c2cccc3ccccc32)C[C@@H]1C ZINC000246550489 1433629947 /nfs/dbraw/zinc/62/99/47/1433629947.db2.gz DLFKPBPTHCWINS-IYWMVGAKSA-N 1 1 397.563 3.447 10 0 GGAEMO C[C@H]1CCCC[N@H+]1CCCNC(=O)NCC[C@H]1CCN(C(=O)OC(C)(C)C)C1 ZINC000246925738 1433688512 /nfs/dbraw/zinc/68/85/12/1433688512.db2.gz AOXFSBNNNKNKKX-ROUUACIJSA-N 1 1 396.576 3.197 10 0 GGAEMO O=C(NC[C@@H]1C[N@@H+](Cc2ccccc2)CCCO1)N[C@H]1C[C@H]1c1cccc(F)c1 ZINC000248656303 1433814108 /nfs/dbraw/zinc/81/41/08/1433814108.db2.gz DMMJVWQFNWINNW-FSSWDIPSSA-N 1 1 397.494 3.272 10 0 GGAEMO CC(C)(C)OC(=O)N[C@@H]1CC[C@H]2C[N@@H+](CC3CCC4(CC3)OCCO4)C[C@H]21 ZINC000248996128 1433831749 /nfs/dbraw/zinc/83/17/49/1433831749.db2.gz HVUANGBOCGASES-RCCFBDPRSA-N 1 1 380.529 3.155 10 0 GGAEMO CCC[C@H](C)[N@H+]1CCC[C@H](CNC(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)C1 ZINC000249093044 1433834992 /nfs/dbraw/zinc/83/49/92/1433834992.db2.gz DUCHDNMFADYWGS-RCCFBDPRSA-N 1 1 381.561 3.403 10 0 GGAEMO COCCO[C@@H]1CC[N@@H+]([C@H](C)C(=O)Nc2ccccc2Cc2ccccc2)C1 ZINC000249295402 1433840672 /nfs/dbraw/zinc/84/06/72/1433840672.db2.gz BATXQRVTAKSMPT-WIYYLYMNSA-N 1 1 382.504 3.342 10 0 GGAEMO COCCO[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2ccccc2Cc2ccccc2)C1 ZINC000249295402 1433840673 /nfs/dbraw/zinc/84/06/73/1433840673.db2.gz BATXQRVTAKSMPT-WIYYLYMNSA-N 1 1 382.504 3.342 10 0 GGAEMO CC[C@]1(CO)CCC[N@@H+]([C@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000249533463 1433846634 /nfs/dbraw/zinc/84/66/34/1433846634.db2.gz BSQHDGWWACTCBB-GCJKJVERSA-N 1 1 384.524 3.301 10 0 GGAEMO CC[C@]1(CO)CCC[N@H+]([C@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)C1 ZINC000249533463 1433846635 /nfs/dbraw/zinc/84/66/35/1433846635.db2.gz BSQHDGWWACTCBB-GCJKJVERSA-N 1 1 384.524 3.301 10 0 GGAEMO CCO[C@H](O)[C@@H]1[NH2+][C@H](c2ccc(Cl)cc2)[C@@H]([N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000252627424 1433863532 /nfs/dbraw/zinc/86/35/32/1433863532.db2.gz RTTHNEXNTOBPTG-QQXKLLMISA-N 1 1 376.840 3.137 10 0 GGAEMO COc1cccc(C[N@H+]2C[C@H](COc3cccnc3)C3(C2)CCOCC3)c1OC ZINC000257174375 1433893171 /nfs/dbraw/zinc/89/31/71/1433893171.db2.gz GBVNVJGIQINWOS-LJQANCHMSA-N 1 1 398.503 3.406 10 0 GGAEMO COCC[N@H+]1CC2(CCN(C(=O)c3ccccc3F)CC2)[C@@H]1c1ccncc1 ZINC000257174021 1433893240 /nfs/dbraw/zinc/89/32/40/1433893240.db2.gz BIZDODQBLCHNKJ-FQEVSTJZSA-N 1 1 383.467 3.146 10 0 GGAEMO Cc1ncsc1C[N@@H+]1CCC[C@H](c2nc(C(C)C)no2)CCNC(=O)CC1 ZINC000257177838 1433893547 /nfs/dbraw/zinc/89/35/47/1433893547.db2.gz FKASUGGTZAGDND-HNNXBMFYSA-N 1 1 391.541 3.234 10 0 GGAEMO CCOc1ccc(CN2CC[C@]3(CO)C[N@@H+](Cc4ccccc4)C[C@@H]3C2)cc1 ZINC000257177125 1433893568 /nfs/dbraw/zinc/89/35/68/1433893568.db2.gz VWUUACLDULGDGF-LADGPHEKSA-N 1 1 380.532 3.402 10 0 GGAEMO Cc1noc([C@@H]2CC3(C[N@H+]2C)CCN(C(=O)c2cc4ccccc4[nH]2)CC3)n1 ZINC000257183473 1433893899 /nfs/dbraw/zinc/89/38/99/1433893899.db2.gz ROWFTXYGJRHNRK-SFHVURJKSA-N 1 1 379.464 3.159 10 0 GGAEMO Cc1noc([C@@H]2CC3(C[N@@H+]2C)CCN(C(=O)c2cc4ccccc4[nH]2)CC3)n1 ZINC000257183473 1433893900 /nfs/dbraw/zinc/89/39/00/1433893900.db2.gz ROWFTXYGJRHNRK-SFHVURJKSA-N 1 1 379.464 3.159 10 0 GGAEMO COc1ccc(C(=O)N2CCC3(CC2)c2[nH]c4ccccc4c2CC[N@H+]3C)cn1 ZINC000257186076 1433894132 /nfs/dbraw/zinc/89/41/32/1433894132.db2.gz KBKNGFZIBAKFMF-UHFFFAOYSA-N 1 1 390.487 3.191 10 0 GGAEMO COc1ccc(C(=O)N2CCC3(CC2)c2[nH]c4ccccc4c2CC[N@@H+]3C)cn1 ZINC000257186076 1433894134 /nfs/dbraw/zinc/89/41/34/1433894134.db2.gz KBKNGFZIBAKFMF-UHFFFAOYSA-N 1 1 390.487 3.191 10 0 GGAEMO CCN(Cc1ccncc1)C(=O)CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](C[N@H+]1C)[C@@H]23 ZINC000257190010 1433894544 /nfs/dbraw/zinc/89/45/44/1433894544.db2.gz OHKIETSLTKQLHT-NXYDZRKXSA-N 1 1 398.595 3.405 10 0 GGAEMO CN(Cc1ccncc1)C[C@@H]1CCC2(CC[NH+](Cc3ccc(O)cc3)CC2)O1 ZINC000257192174 1433894714 /nfs/dbraw/zinc/89/47/14/1433894714.db2.gz STGKBXWLYPJFOO-QFIPXVFZSA-N 1 1 381.520 3.433 10 0 GGAEMO CN(C)C(=O)CCC[C@@H]1[C@H]2CCC[N@H+]3CCC[C@@H](CN1C(=O)c1ccccc1)[C@@H]23 ZINC000257192856 1433894723 /nfs/dbraw/zinc/89/47/23/1433894723.db2.gz RAVWVJWRLVPXTI-GNXKAVGDSA-N 1 1 397.563 3.260 10 0 GGAEMO CN(Cc1cccnc1)C(=O)CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](C[N@H+]1C)[C@@H]23 ZINC000257193806 1433894765 /nfs/dbraw/zinc/89/47/65/1433894765.db2.gz RZQIZNQITKAWIV-GNXKAVGDSA-N 1 1 384.568 3.015 10 0 GGAEMO CC(C)NC(=O)CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](C[N@@H+]1Cc1cccnc1)[C@@H]23 ZINC000257196331 1433894960 /nfs/dbraw/zinc/89/49/60/1433894960.db2.gz YANBSXAJWDYKDZ-NXYDZRKXSA-N 1 1 398.595 3.451 10 0 GGAEMO CC(C)NC(=O)CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](C[N@H+]1Cc1cccnc1)[C@@H]23 ZINC000257196331 1433894961 /nfs/dbraw/zinc/89/49/61/1433894961.db2.gz YANBSXAJWDYKDZ-NXYDZRKXSA-N 1 1 398.595 3.451 10 0 GGAEMO O=C(NCC[C@@H]1CC[NH2+]C1)c1ccsc1NC(=O)c1ccc(Cl)cc1O ZINC000262693639 1433950446 /nfs/dbraw/zinc/95/04/46/1433950446.db2.gz CUCXWQLPPIXZNH-NSHDSACASA-N 1 1 393.896 3.089 10 0 GGAEMO CC(C)[C@@H](C)[N@H+]1Cc2cccc(NC(=O)C(=O)N(C)C[C@@H]3CCCCO3)c2C1 ZINC000263942452 1434051480 /nfs/dbraw/zinc/05/14/80/1434051480.db2.gz DHFDFVQUJKFMIS-AEFFLSMTSA-N 1 1 387.524 3.013 10 0 GGAEMO CC(C)[NH+]1CCN(C2CCN(C(=O)[C@@H]3C[C@@H]3c3c(F)cccc3F)CC2)CC1 ZINC000270837938 1434780147 /nfs/dbraw/zinc/78/01/47/1434780147.db2.gz DRBKFKCJXHXXNK-ZWKOTPCHSA-N 1 1 391.506 3.085 10 0 GGAEMO C[C@@H](C[N@H+](C)Cc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)c1nccs1 ZINC000273013073 1434949981 /nfs/dbraw/zinc/94/99/81/1434949981.db2.gz CMRCYDKKFNGESJ-ZDUSSCGKSA-N 1 1 380.477 3.213 10 0 GGAEMO C[C@@H](C[N@@H+](C)Cc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)c1nccs1 ZINC000273013073 1434949985 /nfs/dbraw/zinc/94/99/85/1434949985.db2.gz CMRCYDKKFNGESJ-ZDUSSCGKSA-N 1 1 380.477 3.213 10 0 GGAEMO C[C@H](C[N@H+](C)Cc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)c1nccs1 ZINC000273013067 1434950038 /nfs/dbraw/zinc/95/00/38/1434950038.db2.gz CMRCYDKKFNGESJ-CYBMUJFWSA-N 1 1 380.477 3.213 10 0 GGAEMO C[C@H](C[N@@H+](C)Cc1nc2c(cnn2-c2ccccc2)c(=O)[nH]1)c1nccs1 ZINC000273013067 1434950040 /nfs/dbraw/zinc/95/00/40/1434950040.db2.gz CMRCYDKKFNGESJ-CYBMUJFWSA-N 1 1 380.477 3.213 10 0 GGAEMO C[C@@H](C[NH+]1CCOCC1)C(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000273018055 1434950607 /nfs/dbraw/zinc/95/06/07/1434950607.db2.gz BXXQESGPRTYOKH-SFHVURJKSA-N 1 1 379.504 3.208 10 0 GGAEMO C[C@H](C[NH+]1CCOCC1)C(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1 ZINC000273018052 1434950663 /nfs/dbraw/zinc/95/06/63/1434950663.db2.gz BXXQESGPRTYOKH-GOSISDBHSA-N 1 1 379.504 3.208 10 0 GGAEMO CCOC(=O)c1sc2nc(C[NH+](C)C)nc(N[C@@H]3CCOC[C@H]3C)c2c1C ZINC000277358408 1435298221 /nfs/dbraw/zinc/29/82/21/1435298221.db2.gz DTHVTPQTSWGAFW-DGCLKSJQSA-N 1 1 392.525 3.075 10 0 GGAEMO COc1c(O)cccc1C[N@@H+](C)C[C@@H]1C[C@H](F)CN1Cc1scnc1C ZINC000280479123 1435667304 /nfs/dbraw/zinc/66/73/04/1435667304.db2.gz DIDNIVJVCNNGGY-HOTGVXAUSA-N 1 1 379.501 3.210 10 0 GGAEMO C[C@@H](C(=O)Nc1ccccc1Cc1ccccc1)[N@@H+]1CC[C@@H]2NC(=O)OC[C@H]2C1 ZINC000281234987 1435800108 /nfs/dbraw/zinc/80/01/08/1435800108.db2.gz FQVLYPJUHVIYMZ-SCWSEQNSSA-N 1 1 393.487 3.035 10 0 GGAEMO C[C@@H](C(=O)Nc1ccccc1Cc1ccccc1)[N@H+]1CC[C@@H]2NC(=O)OC[C@H]2C1 ZINC000281234987 1435800109 /nfs/dbraw/zinc/80/01/09/1435800109.db2.gz FQVLYPJUHVIYMZ-SCWSEQNSSA-N 1 1 393.487 3.035 10 0 GGAEMO COc1ccccc1S(=O)(=O)CCC[N@H+]1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000281293776 1435802703 /nfs/dbraw/zinc/80/27/03/1435802703.db2.gz HAXIHVMZHHDAKI-HCXYKTFWSA-N 1 1 395.565 3.121 10 0 GGAEMO C[C@]1(O)CCOC[C@H]1[C@@H]1CCC[N@H+]1CCOc1ccc(OC(F)(F)F)cc1 ZINC000284705424 1436041581 /nfs/dbraw/zinc/04/15/81/1436041581.db2.gz GPVPNOUFPDHBJK-BZSNNMDCSA-N 1 1 389.414 3.216 10 0 GGAEMO